SCHEMBL8154162

SCHEMBL8154162

CCCc1cc(F)c(C(=O)O)cc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.49
PTPN11 Q06124 2/20 0.49
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
XBP1 P17861 1/20 0.47
HIF1A Q16665 1/20 0.47
HMGCR P04035 2/20 0.44
MCL1 Q07820 2/20 0.44
RARB P10826 3/20 0.43
RARA P10276 2/20 0.43
RARG P13631 1/20 0.43
HCAR2 Q8TDS4 1/20 0.41
KAT8 Q9H7Z6 2/20 0.41
PPARA Q07869 1/20 0.41
PTPN2 P17706 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
ALOX15 P16050 2/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38

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
SCHEMBL29460666 0.81 MAPT (0.56) PTPN1PTPN11LMNAMAPTXBP1
SCHEMBL15524242 0.81 MAPT (0.56) PTPN1PTPN11LMNAMAPTXBP1
SCHEMBL8466537 0.81 PTPN1 (0.40) PTPN1PTPN11LMNAMAPTXBP1
SCHEMBL15524861 0.79 PTPN1 (0.53) PTPN1PTPN11LMNAMAPTXBP1
SCHEMBL6551567 0.78 RARB (0.38) PTPN1PTPN11LMNARARBRARA
SCHEMBL16736769 0.77 HMGCR (0.50) PTPN1PTPN11LMNAMAPTXBP1
SCHEMBL15462898 0.77 GABRP (0.42) LMNARARBRARARARGTSHR
SCHEMBL16736920 0.77 HMGCR (0.53) PTPN1PTPN11LMNAMAPTXBP1
SCHEMBL22222257 0.76 KDM4E (0.47) PTPN1LMNAMAPTHIF1AALDH1A1
SCHEMBL30892458 0.76 KDM4E (0.47) PTPN1LMNAMAPTHIF1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0686145-B1 NEW COMPOUNDS UNIV MARYLAND (US) 2000-01-26 EP disclosed
US-5883129-A Hydroxylated anthranilic acid derivatives ASTRA AKTIEBOLAG (SE) 1999-03-16 US disclosed
US-5523475-A New compounds AKTIEBOLAGET ASTRA (SE) 1996-06-04 US disclosed
CN-1121345-A New compounds ASTRA AB (SE) 1996-04-24 CN disclosed
EP-0686145-A1 NEW COMPOUNDS AKTIEBOLAGET ASTRA (SE) 1995-12-13 EP disclosed
WO-1994019316-A1 NEW COMPOUNDS AKTIEBOLAGET ASTRA (SE) 1994-09-01 WO disclosed