SCHEMBL5772703

SCHEMBL5772703

NC(=O)c1cccc2c(Br)cccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRNP P04156 1/20 0.58
KMT2A Q03164 8/20 0.54
MEN1 O00255 6/20 0.54
ATM Q13315 1/20 0.50
KDM4E B2RXH2 4/20 0.48
ALDH1A1 P00352 2/20 0.48
GAA P10253 1/20 0.48
AHR P35869 1/20 0.46
METAP2 P50579 1/20 0.45
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
AURKA O14965 1/20 0.43
RPS6KB1 P23443 1/20 0.43
PLAU P00749 1/20 0.42
PARP1 P09874 1/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL21828961 0.88 KMT2A (0.60) PRNPKMT2AMEN1ATMKDM4E
SCHEMBL6135290 0.87 ATM (0.61) KMT2AMEN1ATMKDM4EALDH1A1
SCHEMBL148106 0.81 PRNP (0.76) PRNPKMT2AMEN1KDM4EALDH1A1
SCHEMBL634722 0.80 ATM (0.55) KMT2AATMKDM4EALDH1A1GAA
SCHEMBL7424428 0.80 ALDH1A1 (0.46) PRNPKMT2AMEN1ATMKDM4E
SCHEMBL31090849 0.80 ALDH1A1 (0.46) PRNPKMT2AMEN1ATMKDM4E
SCHEMBL6913620 0.79 PRNP (0.73) PRNPKMT2AMEN1KDM4EALDH1A1
SCHEMBL6913244 0.79 PRNP (0.73) PRNPKMT2AMEN1KDM4EALDH1A1
SCHEMBL10405412 0.79 PRNP (0.58) PRNPKMT2AMEN1ALDH1A1AHR
SCHEMBL6913860 0.79 PRNP (0.73) PRNPKMT2AMEN1KDM4EALDH1A1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112945912-B High-brightness large-Stokes-shift wash-free lipid-droplet fluorescent probe and synthetic method and application thereof 中国科学院大连化学物理研究所 2023-02-21 CN claimed
CN-112945912-A High-brightness large-Stokes-shift wash-free lipid-droplet fluorescent probe and synthetic method and application thereof 中国科学院大连化学物理研究所 2021-06-11 CN claimed
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 US disclosed
CN-112945912-B High-brightness large-Stokes-shift wash-free lipid-droplet fluorescent probe and synthetic method and application thereof 中国科学院大连化学物理研究所 2023-02-21 CN disclosed
CN-112945912-A High-brightness large-Stokes-shift wash-free lipid-droplet fluorescent probe and synthetic method and application thereof 中国科学院大连化学物理研究所 2021-06-11 CN disclosed
EP-3275867-B1 PYRIDO-FUSED BICYCLIC COMPOUNDS AS URAT1 INHIBITORS FOR TREATING HYPERURICEMIA SHANGHAI YINGLI PHARM CO LTD (CN) 2020-06-10 EP disclosed
US-20180072678-A1 CONDENSED RING DERIVATIVE, AND PREPARATION METHOD, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE THEREOF SHANGHAI YINGLI PHARMACEUTICAL CO., LTD. (CN) 2018-03-15 US disclosed
WO-2016150255-A1 CONDENSED RING DERIVATIVE, AND PREPARATION METHOD, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE THEREOF 上海璎黎药业有限公司 2016-09-29 WO disclosed
EP-1020446-B1 NAPHTHALIMIDOBENZAMIDE DERIVATIVES TAIHO PHARMACEUTICAL CO LTD (JP) 2006-03-15 EP disclosed
US-6300331-B1 DRUGS AS ANTITUMOR AGENTS OR ANTICARCINOGENIC AGENTS TAIHO PHARMACEUTICAL CO., LTD. (JP) 2001-10-09 US disclosed
EP-1020446-A1 NAPHTHALIMIDOBENZAMIDE DERIVATIVES TAIHO PHARMACEUTICAL CO., LTD. (JP) 2000-07-19 EP 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 (2 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-20180072678-A1 CONDENSED RING DERIVATIVE, AND PREPARATION METHOD, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE THEREOF URB2, UGP2, NLRP3 PRNP 3128/4885KMT2A 821/4885MEN1 2678/4885
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES BCAT1, BCAT2, PELP1 PRNP 735/4885KMT2A 3415/4885MEN1 4354/4885

“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.