SCHEMBL7769690

SCHEMBL7769690

COc1ccc2c(=O)cc(SC)sc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
MAPK1 P28482 2/20 0.48
PRNP P04156 1/20 0.48
PPARG P37231 1/20 0.48
HTT P42858 1/20 0.48
MAPK10 P53779 1/20 0.48
NCOA2 Q15596 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
ALDH1A1 P00352 5/20 0.44
MAPT P10636 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
HPGD P15428 2/20 0.44
TP53 P04637 1/20 0.44
ALOX15 P16050 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL2331968 0.79 ALDH1A1 (0.56) TSHRMAPK1PRNPPPARGHTT
SCHEMBL7774018 0.78 ALDH1A1 (0.41) HTTALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL7774088 0.78 ALDH1A1 (0.39) MAPK1HTTALDH1A1MAPTHPGD
SCHEMBL9016620 0.78 MAOA (0.44) MAPK1ALDH1A1MAPTHPGDALOX15
SCHEMBL7769678 0.78 MAPK1 (0.50) TSHRMAPK1PRNPPPARGHTT
SCHEMBL30017661 0.74 KDM4E (0.67) TSHRMAPK1PRNPPPARGHTT
SCHEMBL13338880 0.74 KDM4E (0.67) TSHRMAPK1PRNPPPARGHTT
SCHEMBL7774397 0.74 HSD17B10 (0.36) HTTALDH1A1HPGDALOX15SMN1; SMN2
SCHEMBL7775951 0.74 STS (0.41) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL7777262 0.74 MAPT (0.43) MAPTHSD17B10KDM4EMIFEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6294527-B1 ANTIBIOTICS FOR METHACILLIN RESISTANT BACTERIA ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 2001-09-25 US disclosed
EP-0949262-B1 CEPHEM COMPOUNDS ZENYAKU KOGYO KK (JP) 2001-08-22 EP disclosed
EP-1090920-A1 CEPHEM COMPOUNDS ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 2001-04-11 EP disclosed
EP-0949262-A1 CEPHEM COMPOUNDS ZENYAKU KOGYO KABUSHIKIKAISHA (JP) 1999-10-13 EP disclosed