SCHEMBL452490

SCHEMBL452490

Brc1cnc2sccc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.36
EGFR P00533 2/20 0.36
CYP2A6 P11509 2/20 0.36
HTT P42858 3/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 5/20 0.32
RAB9A P51151 3/20 0.31
DYRK1B Q9Y463 2/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 3/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
FBP1 P09467 1/20 0.31
DYRK1A Q13627 3/20 0.31
NOS1 P29475 1/20 0.31
METAP2 P50579 1/20 0.31
CSNK2A1 P68400 1/20 0.31
CHEK1 O14757 1/20 0.31
AURKA O14965 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10652292 0.75 MAP4K4 (0.36) ABCG2KMT2ADYRK1BMAPTMAPK1
SCHEMBL451749 0.75 DYRK1A (0.38) ABCG2EGFRCYP2A6HTTKMT2A
SCHEMBL22400521 0.75 MEN1 (0.37) ABCG2EGFRCYP2A6HTTKMT2A
SCHEMBL12483324 0.75 CCR1 (0.48) ABCG2CYP2A6ALDH1A1NOS1KDM4E
SCHEMBL4486974 0.75 ABCG2 (0.39) ABCG2EGFRHTTSMN1; SMN2RAB9A
SCHEMBL24565560 0.75 ABCG2 (0.34) ABCG2DYRK1BDYRK1ACHEK1AURKA
SCHEMBL844341 0.71 HPGDS (0.41) ABCG2HTTKMT2ADYRK1BALDH1A1
SCHEMBL10851948 0.71 ABCG2 (0.42) ABCG2EGFRKMT2ARAB9ANPC1
SCHEMBL25054255 0.71 CYP2A6 (0.55) ABCG2CYP2A6DYRK1BDYRK1ACHEK1
SCHEMBL19436087 0.71 CYP2A6 (0.50) ABCG2CYP2A6RAB9ADYRK1BDYRK1A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112457333-A Organic solar cell receptor material and preparation method thereof 黄培钧 2021-03-09 CN claimed
EP-4709481-A1 5,6-FUSED AND 6,6-FUSED BICYCLIC ALCOHOLS AND ETHERS AND COMPOSITIONS FOR USE AS 15-PROSTAGLANDIN DEHYDROGENASE MODULATORS Amgen Inc. (US) 2026-03-18 EP disclosed
US-12441724-B2 Inhibitors of plasma kallikrein and uses thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-10-14 US disclosed
US-12410194-B2 Potent and selective azaindole inhibitors of CDK8 and CDK19 DANA-FARBER CANCER INSTITUTE, INC. (US) 2025-09-09 US disclosed
US-20240409557-A1 5,6-FUSED AND 6,6-FUSED BICYCLIC ALCOHOLS AND ETHERS AND COMPOSITIONS FOR USE AS 15-PROSTAGLANDIN DEHYDROGENASE MODULATORS AMGEN INC. (US) 2024-12-12 US disclosed
WO-2024233550-A1 5,6-FUSED AND 6,6-FUSED BICYCLIC ALCOHOLS AND ETHERS AND COMPOSITIONS FOR USE AS 15-PROSTAGLANDIN DEHYDROGENASE MODULATORS AMGEN INC. (US) 2024-11-14 WO disclosed
US-20240307547-A1 NOVEL COMPOUNDS WHICH BIND TO CEREBLON, AND METHODS OF USE THEREOF CAPTOR THERAPEUTICS S.A. (PL) 2024-09-19 US disclosed
EP-4271670-A1 NOVEL COMPOUNDS WHICH BIND TO CEREBLON, AND METHODS OF USE THEREOF Captor Therapeutics S.A. (PL) 2023-11-08 EP disclosed
CN-116917275-A Novel CEREBLON-binding compounds and methods of use thereof 凯普托尔治疗学股份有限公司 2023-10-20 CN disclosed
US-20230242556-A1 NOVEL METHOD FOR MANUFACTURING DEUTERATED BORON COMPOUND SFC CO., LTD. (KR) 2023-08-03 US disclosed
US-20080153860-A1 SPIROCYCLIC AZAADAMANTANE DERIVATIVES AND METHODS OF USE ABBOTT LABORATORIES (US) 2008-06-26 US disclosed
US-20060287290-A1 Azabicyclic compounds are central nervous system active agents DART MICHAEL J 2006-12-21 US disclosed
US-7135484-B2 Azabicyclic compounds are central nervous system active agents ABBOTT LABORATORIES (US) 2006-11-14 US disclosed
US-20060148730-A1 Using macrolide and ketolide compound THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2006-07-06 US disclosed
EP-1539733-A2 AZABICYCLIC COMPOUNDS ARE CENTRAL NERVOUS SYSTEM ACTIVE AGENTS Abbott Laboratories (US) 2005-06-15 EP disclosed
WO-2005007143-A2 USE OF MAKROLIDES AND KETOLIDES FOR THE TREATMENT OF TUBERCULOSIS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2005-01-27 WO disclosed
US-20050014706-A1 Method of treating tuberculosis BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS, THE 2005-01-20 US disclosed
US-20040152724-A1 Azabicyclic compounds are central nervous system active agents ABBVIE INC. 2004-08-05 US disclosed
US-20040044029-A1 Azabicyclic compounds are central nervous system active agents ABBOTT LABORATORIES 2004-03-04 US disclosed
WO-2004016604-A2 AZABICYCLIC COMPOUNDS ARE CENTRAL NERVOUS SYSTEM ACTIVE AGENTS ABBOTT LABORATORIES (US) 2004-02-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080153860-A1 SPIROCYCLIC AZAADAMANTANE DERIVATIVES AND METHODS OF USE NR3C2, REN, GNE ABCG2 96/4885EGFR 2772/4885CYP2A6 27/4885
US-20040152724-A1 Azabicyclic compounds are central nervous system active agents ACHE, CHRNA6, CHRNA2 ABCG2 3008/4885EGFR 4664/4885CYP2A6 270/4885
US-20040044029-A1 Azabicyclic compounds are central nervous system active agents ACHE, CHRNA6, CHRNA2 ABCG2 3008/4885EGFR 4664/4885CYP2A6 270/4885
US-20060148730-A1 Using macrolide and ketolide compound MLYCD, TREH, TKT ABCG2 1926/4885EGFR 4487/4885CYP2A6 1095/4885
US-12441724-B2 Inhibitors of plasma kallikrein and uses thereof KLKB1, KLK1, KLK5 ABCG2 960/4885EGFR 3271/4885CYP2A6 2398/4885
US-20240409557-A1 5,6-FUSED AND 6,6-FUSED BICYCLIC ALCOHOLS AND ETHERS AND COMPOSITIONS FOR USE AS 15-PROSTAGLANDIN DEHYDROGENASE MODULATORS HPGD, ADH1A, ADH5 ABCG2 2782/4885EGFR 3645/4885CYP2A6 13/4885
US-20230242556-A1 NOVEL METHOD FOR MANUFACTURING DEUTERATED BORON COMPOUND BCL6B, BRD7, DBF4 ABCG2 1331/4885EGFR 3636/4885CYP2A6 1832/4885
US-12410194-B2 Potent and selective azaindole inhibitors of CDK8 and CDK19 CDK8, CDK9, CDK19 ABCG2 2619/4885EGFR 2752/4885CYP2A6 3758/4885
US-20050014706-A1 Method of treating tuberculosis TREH, TKT, DCXR ABCG2 2783/4885EGFR 4535/4885CYP2A6 924/4885
US-20240307547-A1 NOVEL COMPOUNDS WHICH BIND TO CEREBLON, AND METHODS OF USE THEREOF CRBN, CDR2, FABP7 ABCG2 113/4885EGFR 3394/4885CYP2A6 3765/4885
US-20060287290-A1 Azabicyclic compounds are central nervous system active agents ACHE, CHAT, CHRNA6 ABCG2 2597/4885EGFR 4720/4885CYP2A6 246/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.