SCHEMBL7912879

SCHEMBL7912879

Cc1cccc(Nc2ccccc2-c2n[nH]c(=S)o2)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.65
KDM4E B2RXH2 6/20 0.65
PPARG P37231 5/20 0.65
NCOA2 Q15596 5/20 0.65
RXFP1 Q9HBX9 5/20 0.65
NCOA1 Q15788 4/20 0.65
NPSR1 Q6W5P4 2/20 0.65
PRNP P04156 1/20 0.65
MAPK10 P53779 1/20 0.65
KMT2A Q03164 4/20 0.50
HSD17B10 Q99714 3/20 0.50
MEN1 O00255 3/20 0.50
TTR P02766 1/20 0.50
MAPK1 P28482 1/20 0.50
MAPT P10636 3/20 0.48
HPGD P15428 3/20 0.48
TDP1 Q9NUW8 3/20 0.48
GAA P10253 1/20 0.48
ALOX15 P16050 1/20 0.48
ALOX12 P18054 1/20 0.48

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
SCHEMBL9266309 0.84 NOTUM (0.65) ALDH1A1KDM4EPPARGNCOA2RXFP1
SCHEMBL10440603 0.79 ALDH1A1 (0.51) ALDH1A1KDM4EPPARGNCOA2RXFP1
SCHEMBL7913006 0.79 ALDH1A1 (0.56) ALDH1A1KDM4EPPARGNCOA2RXFP1
SCHEMBL7902075 0.77 CLCN2 (0.57) ALDH1A1KDM4EPPARGNCOA2RXFP1
SCHEMBL7902562 0.77 ALDH1A1 (0.48) ALDH1A1KDM4EPPARGNCOA2RXFP1
SCHEMBL7902568 0.77 ALDH1A1 (0.48) ALDH1A1KDM4EPPARGNCOA2RXFP1
SCHEMBL9551848 0.77 ALDH1A1 (0.46) ALDH1A1KDM4EPPARGNCOA2RXFP1
SCHEMBL7910151 0.75 ALDH1A1 (0.46) ALDH1A1KDM4EPPARGNCOA2RXFP1
SCHEMBL7912983 0.75 ALDH1A1 (0.46) ALDH1A1KDM4EPPARGNCOA2RXFP1
SCHEMBL9261365 0.72 ALDH1A1 (0.49) ALDH1A1KDM4EPPARGNCOA2RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6211209-B1 NONDEGRADING TISSUES, DRUGS, DIPHENYLAMINES WARNER-LAMBERT COMPANY 2001-04-03 US claimed
EP-0401857-A2 Fenamate 1,3,4-thiadiazoles and 1,3,4-oxadiazoles as antiinflammatory agents WARNER-LAMBERT COMPANY (US) 1990-12-12 EP claimed
US-6211209-B1 NONDEGRADING TISSUES, DRUGS, DIPHENYLAMINES WARNER-LAMBERT COMPANY 2001-04-03 US disclosed
US-5462952-A Have activity as inhibitors of 5-lipoxygenase and/or cyclooxygenase WARNER-LAMBERT COMPANY (US) 1995-10-31 US disclosed
EP-0401857-A2 Fenamate 1,3,4-thiadiazoles and 1,3,4-oxadiazoles as antiinflammatory agents WARNER-LAMBERT COMPANY (US) 1990-12-12 EP disclosed