SCHEMBL1753879

SCHEMBL1753879

CN1CCC2(CC1)CC(=O)N(C)C2

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 4/20 0.50
CYP11B2 P19099 4/20 0.50
CRBN Q96SW2 1/20 0.42
CHRM2 P08172 1/20 0.41
CHRM3 P20309 1/20 0.41
NEK2 P51955 1/20 0.36
TSHR P16473 1/20 0.35
LRRK2 Q5S007 1/20 0.34

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
SCHEMBL12832226 0.90 CYP11B1 (0.46) CYP11B1CYP11B2CRBNCHRM2CHRM3
SCHEMBL16189944 0.87
SCHEMBL21990818 0.86 CYP11B1 (0.42) CYP11B1CYP11B2CRBNCHRM2CHRM3
SCHEMBL21557329 0.85 CHRM2 (0.42) CYP11B1CYP11B2CRBNCHRM2CHRM3
SCHEMBL21557290 0.82 BRD4 (0.40) CYP11B1CYP11B2CRBNCHRM2CHRM3
SCHEMBL24186788 0.81 CYP11B1 (0.46) CYP11B1CYP11B2CRBNLRRK2
SCHEMBL17485296 0.81 CYP11B1 (0.49) CYP11B1CYP11B2CRBNCHRM2CHRM3
SCHEMBL9968466 0.81 CYP11B1 (0.46) CYP11B1CYP11B2CRBNCHRM2LRRK2
SCHEMBL12243268 0.81 CYP11B1 (0.44) CYP11B1CYP11B2CRBN
SCHEMBL14359443 0.80 CYP11B1 (0.43) CYP11B1CYP11B2CRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024107746-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN LARKSPUR BIOSCIENCES (US) 2024-05-23 WO disclosed
US-20230357249-A1 ANDROGEN RECEPTOR PROTEIN DEGRADERS WITH A TRICYCLIC CEREBLON LIGAND UNIV MICHIGAN REGENTS (US) 2023-11-09 US disclosed
EP-4223754-A1 COMPOUND AS AKT KINASE INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-08-09 EP disclosed
EP-3567030-B1 QUINAZOLINE COMPOUND FOR EGFR INHIBITION MEDSHINE DISCOVERY INC (CN) 2022-02-09 EP disclosed
US-11040984-B2 Quinazoline compound for EGFR inhibition MEDSHINE DISCOVERY INC. (CN) 2021-06-22 US disclosed
EP-3792260-A1 AZABENZIMIDAZOLE COMPOUNDS AND PHARMACEUTICAL Nippon Shinyaku Co., Ltd. (JP) 2021-03-17 EP disclosed
WO-2020247298-A2 1-PYRAZOLYL, 5-, 6- DISUBSTITUTED INDAZOLE DERIVATIVES AS LRRK2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MERCK SHARP & DOHME CORP. (US) 2020-12-10 WO disclosed
EP-3674291-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT Nippon Soda Co., Ltd. (JP) 2020-07-01 EP disclosed
US-20200190107-A1 QUINAZOLINE COMPOUND FOR EGFR INHIBITION MEDSHINE DISCOVERY INC. (CN) 2020-06-18 US disclosed
US-20200163336-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2020-05-28 US disclosed
EP-3567030-A1 QUINAZOLINE COMPOUND FOR EGFR INHIBITION Medshine Discovery Inc. (CN) 2019-11-13 EP disclosed
EP-2630134-B9 PYRIDINE-2- DERIVATIVES AS SMOOTHENED RECEPTOR MODULATORS PFIZER (US) 2018-04-18 EP disclosed
US-9056865-B2 Pyridine-2-derivatives as smoothened receptor modulators PFIZER INC. (US) 2015-06-16 US disclosed
US-20130210800-A1 PYRIDINE-2-DERIVATIVES AS SMOOTHENED RECEPTOR MODULATORS PFIZER INC. (US) 2013-08-15 US disclosed
WO-2013091507-A1 HETEROCYCLE AMIDO ALKYLOXY SUBSTITUTED QUINAZOLINE DERIVATIVE AND USE THEREOF QIAN WEI (CN) 2013-06-27 WO disclosed
US-8158643-B2 Substituted diaza-spiro-pyridinone derivatives for use in MCH-1 mediated diseases JANSSEN PHARMACEUTICA N.V. (BE) 2012-04-17 US disclosed
US-8158643-B2 Substituted diaza-spiro-pyridinone derivatives for use in MCH-1 mediated diseases JANSSEN PHARMACEUTICA N.V. (BE) 2012-04-17 US disclosed
WO-2011148962-A1 NOVEL HETEROCYCLIC COMPOUND OR SALT THEREOF 大正製薬株式会社 (JP) 2011-12-01 WO disclosed
US-20100035909-A1 NOVEL SUBSTITUTED DIAZA-SPIRO-PYRIDINONE DERIVATIVES FOR USE IN MCH-1 MEDIATED DISEASES JANSSEN PHARMACEUTICA N.V. (BE) 2010-02-11 US disclosed
US-20100035909-A1 NOVEL SUBSTITUTED DIAZA-SPIRO-PYRIDINONE DERIVATIVES FOR USE IN MCH-1 MEDIATED DISEASES JANSSEN PHARMACEUTICA N.V. (BE) 2010-02-11 US 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 (6 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-11040984-B2 Quinazoline compound for EGFR inhibition EGFR, ERBB2, ERBB4 CYP11B1 3649/4885CYP11B2 3278/4885CRBN 3669/4885
US-20230357249-A1 ANDROGEN RECEPTOR PROTEIN DEGRADERS WITH A TRICYCLIC CEREBLON LIGAND AR, GPER1, CRBN CYP11B1 84/4885CYP11B2 195/4885CRBN 3/4885
US-20200190107-A1 QUINAZOLINE COMPOUND FOR EGFR INHIBITION EGFR, ERBB2, ERBB4 CYP11B1 3649/4885CYP11B2 3278/4885CRBN 3669/4885
US-20100035909-A1 NOVEL SUBSTITUTED DIAZA-SPIRO-PYRIDINONE DERIVATIVES FOR USE IN MCH-1 MEDIATED DISEASES MCHR1, MCHR2, MC1R CYP11B1 25/4885CYP11B2 62/4885CRBN 3893/4885
US-20200163336-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT H1-10, TAAR1, C5 CYP11B1 2392/4885CYP11B2 2532/4885CRBN 2533/4885
US-20130210800-A1 PYRIDINE-2-DERIVATIVES AS SMOOTHENED RECEPTOR MODULATORS SMO, EDNRB, RXFP1 CYP11B1 1843/4885CYP11B2 1883/4885CRBN 987/4885

“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.