SCHEMBL16635226

SCHEMBL16635226

CCC1(C(=O)O)CCc2ccccc2O1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.59
PPARA Q07869 17/20 0.59
PPARD Q03181 3/20 0.48
TRPM8 Q7Z2W7 1/20 0.44
SIGMAR1 Q99720 1/20 0.43

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
SCHEMBL27821524 1.00 PPARG (0.59) PPARGPPARAPPARDTRPM8SIGMAR1
SCHEMBL30613915 1.00 PPARG (0.59) PPARGPPARAPPARDTRPM8SIGMAR1
SCHEMBL3380544 0.84 PPARA (0.44) PPARGPPARAPPARD
SCHEMBL7420613 0.84 PPARA (0.44) PPARGPPARAPPARD
SCHEMBL10708009 0.81 PPARG (0.50) PPARGPPARAPPARD
SCHEMBL6791705 0.81 PPARG (0.58) PPARGPPARAPPARD
SCHEMBL10324581 0.80 PPARG (0.56) PPARGPPARAPPARDTRPM8
SCHEMBL6798234 0.78 PPARG (0.72) PPARGPPARAPPARD
SCHEMBL8426777 0.77 TRPM8 (0.42) PPARGPPARATRPM8SIGMAR1
SCHEMBL3519974 0.76 TRPM8 (0.47) PPARGPPARAPPARDTRPM8SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024146868-A1 COMPOSITIONS FOR HORMONALLY IMPACTED SKIN THE BOOTS COMPANY PLC (GB) 2024-07-11 WO disclosed
WO-2023071973-A1 FUSED BICYCLIC COMPOUND FOR INHIBITING ACTIVITY OF TYROSINE KINASE SHENZHEN TARGETRX, INC. (CN) 2023-05-04 WO disclosed
WO-2020162612-A1 PYRIDINE COMPOUND SUBSTITUTED BY HETEROARYL 大正製薬株式会社 2020-08-13 WO disclosed
WO-2016192074-A1 BTK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-12-08 WO disclosed
WO-2016161571-A1 INDAZOLE AND AZAINDAZOLE BTK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-10-13 WO disclosed
WO-2016106629-A1 BTK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-07-07 WO disclosed
WO-2016106625-A1 BTK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-07-07 WO disclosed
WO-2016106628-A1 BTK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-07-07 WO disclosed
WO-2016106624-A1 TERTIARY ALCOHOL IMIDAZOPYRAZINE BTK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-07-07 WO disclosed
WO-2016106623-A1 BENZAMIDE IMIDAZOPYRAZINE BTK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-07-07 WO disclosed
WO-2016106627-A1 BTK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-07-07 WO disclosed
WO-2016106626-A1 IMIDAZOPYRAZINE ANALOGS WITH 3-TERTIARY CARBON SUBSTITUTIONS AS BTK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-07-07 WO disclosed
WO-2016106652-A1 BIARYLETHER IMIDAZOPYRAZINE BTK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-07-07 WO disclosed
WO-2016095088-A1 ERK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-06-23 WO disclosed
WO-2015051766-A1 AMIDS SUBSTITUTED INDAZOLE DERIVATIVEES AS PLOY (ADP-RIBOSE) POLYMERASE INHIBITORS BETTA PHARMACEUTICALS CO., LTD (CN) 2015-04-16 WO disclosed
CN-101133024-A Amide derivatives as histone deacetylase inhibitors ANGELETTI P IST RICHERCHE BIO (IT) 2008-02-27 CN disclosed
CN-1980911-A Mitotic kinesin inhibitors MERCK & CO INC (US) 2007-06-13 CN disclosed