SCHEMBL9251071

SCHEMBL9251071

Cc1cc(C)n(-c2ccc(Cl)cc2)c(=O)c1C(=O)O.[NaH]

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 4/20 0.56
POLB P06746 1/20 0.53
ALDH1A1 P00352 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.45
KDM4E B2RXH2 5/20 0.44
LMNA P02545 2/20 0.44
MAPK1 P28482 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
USP2 O75604 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ALKBH5 Q6P6C2 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 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
SCHEMBL6751094 0.98 NOTUM (0.57) NOTUMPOLBALDH1A1L3MBTL1KDM4E
SCHEMBL680088 0.84 ALDH1A1 (0.54) NOTUMPOLBALDH1A1L3MBTL1KDM4E
4-Cyanophenol SCHEMBL27697371 0.84 TDP2 (0.48) NOTUMPOLBALDH1A1L3MBTL1KDM4E
SCHEMBL9251057 0.84 POLB (0.51) NOTUMPOLBALDH1A1L3MBTL1KDM4E
SCHEMBL11462311 0.84 NOTUM (0.59) NOTUMPOLBALDH1A1L3MBTL1KDM4E
SCHEMBL680519 0.84 L3MBTL1 (0.63) NOTUMPOLBALDH1A1L3MBTL1KDM4E
SCHEMBL9740604 0.83 KMT2A (0.44) NOTUMPOLBALDH1A1L3MBTL1KDM4E
SCHEMBL31686290 0.78 NOTUM (0.48) NOTUMPOLBALDH1A1L3MBTL1KDM4E
SCHEMBL11455800 0.78 NOTUM (0.54) NOTUMPOLBALDH1A1KDM4ELMNA
SCHEMBL11626968 0.78 NOTUM (0.66) NOTUMPOLBALDH1A1LMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5472946-A Topical administration of lincomycin, clindamycin, erthromycin and iododeoxyuridine on skin or mucuous membranes DISCOVERY THERAPEUTICS, INC. 1995-12-05 US disclosed
EP-0582065-A1 1-Oxohydrocarbyl-substituted azacyclohexanes compositions used as acid catalyst WHITBY RESEARCH, Inc. (US) 1994-02-09 EP disclosed
US-5113617-A Diazabicyclo/2.2.2/octane ARIZONA BOARD OF REGENTS ON BEHALF OF UNIVERSITY OF ARIZONA (US) 1992-05-19 US disclosed
US-4925477-A 1,4-DIAZABICYCLO(2.2.2) OCTANE DERIVATIVES RESEARCH CORPORATION (US) 1990-05-15 US disclosed
EP-0267277-A4 COMPOSITIONS COMPRISING 1-SUBSTITUTED LACTAMS. NELSON RES & DEV COMPANY (US) 1990-03-21 EP disclosed
EP-0280703-A4 COMPOSITIONS COMPRISING 1-ACYL-SUBSTITUTED MORPHOLINES, THIOMORPHOLINES AND PIPERAZINES AND THEIR USES. NELSON RES & DEV COMPANY (US) 1990-01-08 EP disclosed
EP-0329669-A4 COMPOSITIONS COMPRISING N,N-DIALKYLALKANAMIDES AND THEIR USES. NELSON RES & DEV COMPANY (US) 1989-12-12 EP disclosed
US-4886545-A IMPROVE DELIVERY OF PLANT NUTRIENTS NELSON RESEARCH & DEVELOPMENT COMPANY (US) 1989-12-12 US disclosed
WO-1989011275-A1 PENETRATION ENHANCERS FOR TRANSDERMAL DELIVERY OF SYSTEMIC AGENTS NELSON RESEARCH & DEVELOPMENT CO. (US) 1989-11-30 WO disclosed
EP-0329669-A1 COMPOSITIONS COMPRISING N,N-DIALKYLALKANAMIDES AND THEIR USES Whitby Research Incorporated (US) 1989-08-30 EP disclosed
EP-0267277-A1 COMPOSITIONS COMPRISING 1-SUBSTITUTED LACTAMS. NELSON RES & DEV (US) 1988-05-18 EP disclosed
WO-1988002216-A1 COMPOSITIONS COMPRISING N,N-DIALKYLALKANAMIDES AND THEIR USES NELSON RESEARCH AND DEVELOPMENT COMPANY (US) 1988-04-07 WO disclosed
EP-0258385-A1 COMPOSITIONS COMPRISING 1-SUBSTITUTED AZACYCLOALKANES AND THEIR USES Whitby Research Incorporated (US) 1988-03-09 EP disclosed
EP-0257063-A1 COMPOSITIONS COMPRISING 1-SUBSTITUTED AZACYCLOALKANES AND THEIR USES. NELSON RES & DEV (US) 1988-03-02 EP disclosed
EP-0257086-A1 Skinpenetration enhancing compositions. NELSON RES & DEV (US) 1988-03-02 EP disclosed
WO-1988001131-A1 COMPOSITIONS COMPRISING 1-OXOHYDROCARBYL-SUBSTITUTED AZACYCLOHEXANES AND THEIR USES NELSON RESEARCH AND DEVELOPMENT COMPANY (US) 1988-02-25 WO disclosed
WO-1987006583-A1 COMPOSITIONS COMPRISING 1-SUBSTITUTED LACTAMS NELSON RESEARCH AND DEVELOPMENT COMPANY (US) 1987-11-05 WO disclosed
WO-1987004593-A1 COMPOSITIONS COMPRISING 1-SUBSTITUTED AZACYCLOALKANES AND THEIR USES NELSON RESEARCH AND DEVELOPMENT COMPANY (US) 1987-08-13 WO disclosed
WO-1987004594-A1 COMPOSITIONS COMPRISING 1-SUBSTITUTED AZACYCLOALKANES AND THEIR USES NELSON RESEARCH AND DEVELOPMENT COMPANY (US) 1987-08-13 WO disclosed
WO-1987004706-A1 COMPOSITIONS COMPRISING 1-SUBSTITUTED AZACYCLOALKANES AND THEIR USES NELSON RESEARCH AND DEVELOPMENT COMPANY (US) 1987-08-13 WO disclosed