SCHEMBL8186259

SCHEMBL8186259

CC(C)N1CCN(C2CCCCC2)CC1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.53
SIGMAR1 Q99720 2/20 0.46
CHRM2 P08172 7/20 0.44
CHRM1 P11229 7/20 0.44
TSHR P16473 3/20 0.44
TP53 P04637 1/20 0.44
PHGDH O43175 1/20 0.42
MGLL Q99685 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM3 P20309 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL12858869 1.00 HRH3 (0.53) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL10092689 0.98 HRH3 (0.50) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL12396793 0.93 HRH3 (0.46) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL24742908 0.91 HRH3 (0.47) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL22456382 0.91 HRH3 (0.49) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL10162384 0.90 HRH3 (0.46) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL10092700 0.88 HRH3 (0.41) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL10162381 0.87 HRH3 (0.43) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL6743387 0.86 SIGMAR1 (0.46) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL14453902 0.86 HRH3 (0.41) HRH3TSHRTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240217952-A1 TREATMENT OF GRAFT-VERSUS-HOST DISEASE WITH INHIBITORS OF BET FAMILY BDII BROMODOMAIN POSEIDON INNOVATION 1, INC. 2024-07-04 US disclosed
US-11802132-B2 Small molecules for inducing selective protein degradation and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-31 US disclosed
WO-2023118319-A1 RIFABUTIN ANALOGS FOR THE TREATMENT OF DISEASE BioVersys AG (CH) 2023-06-29 WO disclosed
US-20230131025-A1 QUINOLYL PHOSPHINE OXIDE COMPOUND, AND COMPOSITION AND APPLICATION THEREOF BETTA PHARMACEUTICALS CO., LTD. (CN) 2023-04-27 US disclosed
US-20220402948-A1 EGFR INHIBITOR, COMPOSITION AND PREPARATION METHOD THEREFOR BETTA PHARMACEUTICALS CO., LTD. (CN) 2022-12-22 US disclosed
US-20210317120-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2021-10-14 US disclosed
EP-3383877-B1 HETEROCYCLE COMPOUNDS AND USES THEREOF ZHEJIANG JIANFENG YIEN BIOTECHNOLOGY CO LTD (CN) 2021-09-15 EP disclosed
WO-2021160087-A1 QUINOLYL PHOSPHINE OXIDE COMPOUND, AND COMPOSITION AND APPLICATION THEREOF 贝达药业股份有限公司 2021-08-19 WO disclosed
US-11046670-B2 Piperazinyl norbenzomorphan compounds and methods for using the same BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-06-29 US disclosed
WO-2021107023-A1 CYCLOALKYL UREA DERIVATIVE 大日本住友製薬株式会社 2021-06-03 WO disclosed
US-7414067-B2 Ophthalmic compositions for treating ocular hypertension MERCK & CO. INC. (US) 2008-08-19 US disclosed
US-7256186-B2 Gamma secretase inhibitors SCHERING CORPORATION (US) 2007-08-14 US disclosed
US-20070105861-A1 NOVEL VANILLOID RECEPTOR LIGANDS AND USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICAL PREPARATIONS GRUENENTHAL GMBH (DE) 2007-05-10 US disclosed
US-7208602-B2 Gamma secretase inhibitors SCHERING CORPORATION (US) 2007-04-24 US disclosed
US-7208602-B2 Gamma secretase inhibitors SCHERING CORPORATION (US) 2007-04-24 US disclosed
US-20070049555-A1 Indenoisoquinolinone analogs and methods of use thereof INOTEK PHARMACEUTICALS CORPORATION (US) 2007-03-01 US disclosed
US-20070049555-A1 Indenoisoquinolinone analogs and methods of use thereof INOTEK PHARMACEUTICALS CORPORATION (US) 2007-03-01 US disclosed
US-20050085506-A1 Novel gamma secretase inhibitors SCHERING-PLOUGH CORPORATION AND PHARMACOPEIA, INC. 2005-04-21 US disclosed
US-20040171614-A1 Novel gamma secretase inhibitors SCHERING-PLOUGH CORPORATION 2004-09-02 US disclosed
US-20040171614-A1 Novel gamma secretase inhibitors SCHERING-PLOUGH CORPORATION 2004-09-02 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 (10 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-20230131025-A1 QUINOLYL PHOSPHINE OXIDE COMPOUND, AND COMPOSITION AND APPLICATION THEREOF EGFR, ABL1, ERBB2 HRH3 801/4885SIGMAR1 2560/4885CHRM2 3513/4885
US-20040171614-A1 Novel gamma secretase inhibitors BACE1, BACE2, APP HRH3 789/4885SIGMAR1 344/4885CHRM2 1541/4885
US-20070105861-A1 NOVEL VANILLOID RECEPTOR LIGANDS AND USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICAL PREPARATIONS TRPV1, TRPV5, TRPV2 HRH3 335/4885SIGMAR1 180/4885CHRM2 421/4885
US-20070049555-A1 Indenoisoquinolinone analogs and methods of use thereof TNNI3, IDH2, GLS HRH3 3631/4885SIGMAR1 3790/4885CHRM2 2922/4885
US-11046670-B2 Piperazinyl norbenzomorphan compounds and methods for using the same GAP43, NCDN, NLN HRH3 2740/4885SIGMAR1 1288/4885CHRM2 602/4885
US-20240217952-A1 TREATMENT OF GRAFT-VERSUS-HOST DISEASE WITH INHIBITORS OF BET FAMILY BDII BROMODOMAIN BRDT, BET1, BRD4 HRH3 454/4885SIGMAR1 4289/4885CHRM2 4748/4885
US-20210317120-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM BAX, CASP3, CASP7 HRH3 4688/4885SIGMAR1 3021/4885CHRM2 4811/4885
US-20050085506-A1 Novel gamma secretase inhibitors BACE1, BACE2, APP HRH3 278/4885SIGMAR1 391/4885CHRM2 338/4885
US-11802132-B2 Small molecules for inducing selective protein degradation and uses thereof BAZ2A, BRD3, BRPF3 HRH3 331/4885SIGMAR1 4016/4885CHRM2 4433/4885
US-20220402948-A1 EGFR INHIBITOR, COMPOSITION AND PREPARATION METHOD THEREFOR EGFR, ERBB2, ERBB3 HRH3 3450/4885SIGMAR1 2925/4885CHRM2 4836/4885

“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.