SCHEMBL328889

SCHEMBL328889

CC12CCC(N)(CC1)CC2

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
GRIN1 Q05586 2/20 0.33
GRIN2A Q12879 2/20 0.33
SLC22A1 O15245 1/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
ESR1 P03372 1/20 0.33
ADRB3 P13945 1/20 0.33
ACHE P22303 1/20 0.33
OPRK1 P41145 1/20 0.33
MTOR P42345 1/20 0.33
HTT P42858 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
NFKB1 P19838 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
Hydrochloric Acid SCHEMBL10409914 0.96 LMNA (0.36) LMNAGRIN1GRIN2ASLC22A1GRIN2D
SCHEMBL20198595 0.85
SCHEMBL12757988 0.79
SCHEMBL9815660 0.78
SCHEMBL1903771 0.78 PNMT (0.40) LMNAGRIN1GRIN2ASLC22A1GRIN2D
Hydrochloric Acid SCHEMBL2875147 0.74 PNMT (0.38) LMNAPNMTPMP22
SCHEMBL9951831 0.70 LMNA (0.36) LMNAGRIN1GRIN2ASLC22A1GRIN2D
SCHEMBL19850684 0.67 PNMT (0.35) PNMT
SCHEMBL22842441 0.67 LMNA (0.32) LMNAGRIN1GRIN2ASLC22A1GRIN2D
SCHEMBL71836 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11787814-B2 Method for preparing 2-indolinospirone compound and intermediate thereof ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2023-10-17 US disclosed
US-11649224-B2 IRE1 small molecule inhibitors CORNELL UNIVERSITY (US) 2023-05-16 US disclosed
US-20200345700-A1 LSD1 INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF MEDSHINE DISCOVERY INC. (CN) 2020-11-05 US disclosed
WO-2019075004-A1 SYNTHESIS OF BICYCLO[2.2.2]OCTANE DERIVATIVES EASTMAN CHEMICAL COMPANY (US) 2019-04-18 WO disclosed
US-9944666-B2 Compounds that are S1P modulating agents and/or ATX modulating agents BIOGEN MA INC. (US) 2018-04-17 US disclosed
EP-3271334-A1 SUBSTITUTED N-BICYCLO-2-ARYL-QUINOLIN-4-CARBOXAMIDES AND USE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2018-01-24 EP disclosed
US-9650573-B2 Liquid crystalline medium and liquid crystal device MERCK PATENT GMBH (DE) 2017-05-16 US disclosed
WO-2016146602-A1 SUBSTITUTED N-BICYCLO-2-ARYL-QUINOLIN-4-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-09-22 WO disclosed
US-20160108318-A1 LIQUID CRYSTALLINE MEDIUM AND LIQUID CRYSTAL DEVICE MERCK PATENT GMBH (DE) 2016-04-21 US disclosed
US-20160060530-A1 DEVICE CONTAINING A LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2016-03-03 US disclosed
US-7435833-B2 Inhibitors of the 11-beta-hydroxysteroid dehydrogenase Type 1 enzyme ABBOTT LABORATORIES (US) 2008-10-14 US disclosed
WO-2008100423-A1 GUT MICROSOMAL TRIGLYCERIDE TRANSPORT PROTEIN INHIBITORS SIRTRIS PHARMACEUTICALS, INC. (US) 2008-08-21 WO disclosed
WO-2008063714-A1 METABOLICALLY-STABILIZED INHIBITORS OF FATTY ACID AMIDE HYDROLASE N.V. ORGANON (NL) 2008-05-29 WO disclosed
US-20080119549-A1 METABOLICALLY-STABILIZED INHIBITORS OF FATTY ACID AMIDE HYDROLASE N.V. ORGANON (NL) 2008-05-22 US disclosed
US-20080076819-A1 INHIBITORS OF THE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ENZYME ABBOTT LABORATORIES (US) 2008-03-27 US disclosed
US-20070281938-A1 Inhibitors of 11-Beta-Hydroxy Steroid Dehydrogenase Type 1 AMGEN INC. 2007-12-06 US disclosed
WO-2007118185-A2 INHIBITORS OF THE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ENZYME ABBOTT LABORATORIES (US) 2007-10-18 WO disclosed
US-20070167501-A1 Bicyclo derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-07-19 US disclosed
EP-1719757-A1 BICYCLO DERIVATIVE Kyorin Pharmaceutical Co., Ltd. (JP) 2006-11-08 EP disclosed
EP-0107801-B1 PROCESS FOR ELECTROLESS PLATING OF METAL SURFACES WITH LAYERS OF METAL Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1987-05-27 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 (7 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-20080076819-A1 INHIBITORS OF THE 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ENZYME HSD11B1, HSD11B2, HSD17B1 LMNA 3653/4885GRIN1 324/4885GRIN2A 929/4885
US-20080119549-A1 METABOLICALLY-STABILIZED INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, ABHD6 LMNA 4058/4885GRIN1 2877/4885GRIN2A 2768/4885
US-11787814-B2 Method for preparing 2-indolinospirone compound and intermediate thereof CYP51A1, CYP11B2, CYP3A5 LMNA 1424/4885GRIN1 3413/4885GRIN2A 2326/4885
US-20070167501-A1 Bicyclo derivative DPP4, DPP7, DPP9 LMNA 4789/4885GRIN1 284/4885GRIN2A 708/4885
US-11649224-B2 IRE1 small molecule inhibitors XBP1, ERN2, ERN1 LMNA 2127/4885GRIN1 4736/4885GRIN2A 4756/4885
US-20070281938-A1 Inhibitors of 11-Beta-Hydroxy Steroid Dehydrogenase Type 1 HSD11B1, HSD3B1, HSD17B1 LMNA 2340/4885GRIN1 475/4885GRIN2A 2054/4885
US-20200345700-A1 LSD1 INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF KDM1B, KDM1A, KDM2A LMNA 1018/4885GRIN1 408/4885GRIN2A 800/4885

“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.