SCHEMBL9201256

SCHEMBL9201256

COc1ccc(-c2nc(CCCCCCCC(=O)O)[nH]c2-c2ccc(OC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
GAA P10253 3/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 1/20 0.49
CYP1A2 P05177 1/20 0.49
GLA P06280 1/20 0.49
CYP2C19 P33261 1/20 0.49
GFER P55789 1/20 0.49
NOX1 Q9Y5S8 1/20 0.47
TP53 P04637 2/20 0.46
TGFBR1 P36897 1/20 0.46
LTB4R Q15722 1/20 0.45
LMNA P02545 1/20 0.44
ATM Q13315 1/20 0.44
SMPD3 Q9NY59 1/20 0.44
MAPK13 O15264 1/20 0.44
RAF1 P04049 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
SCHEMBL9201163 0.86 NOX1 (0.44) MAPTGAAALDH1A1HPGDMEN1
SCHEMBL9194841 0.85 TGFBR1 (0.47) MAPTALDH1A1MEN1KMT2ANOX1
SCHEMBL9193870 0.85 RXRA (0.51) MAPTHPGDMEN1KMT2AKDM4E
SCHEMBL10921523 0.82 MAPT (0.55) MAPTGAAALDH1A1HPGDMEN1
SCHEMBL11073588 0.81 MAPT (0.54) MAPTGAAALDH1A1HPGDMEN1
SCHEMBL11283662 0.79 NOX1 (0.56) MAPTGAAALDH1A1HPGDMEN1
SCHEMBL9347725 0.79 CYP1A2 (0.56) CYP1A2CYP2C19MAPK14
SCHEMBL11071586 0.78 MAPT (0.51) MAPTGAAALDH1A1HPGDMEN1
SCHEMBL11062464 0.78 NOX1 (0.49) MAPTGAAALDH1A1HPGDMEN1
SCHEMBL4756835 0.77 MAPT (0.50) MAPTGAAALDH1A1HPGDMEN1

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
EP-0626969-A4 CoA-IT AND PAF INHIBITORS. SMITHKLINE BEECHAM CORP (US) 1995-04-19 EP disclosed
EP-0626969-A1 CoA-IT AND PAF INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1994-12-07 EP disclosed
WO-1993016674-A1 CoA-IT AND PAF INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1993-09-02 WO disclosed
EP-0550502-A1 SUBSTITUTED IMIDAZOLES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1993-07-14 EP disclosed
WO-1992004330-A1 SUBSTITUTED IMIDAZOLES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1992-03-19 WO disclosed