SCHEMBL7698148

SCHEMBL7698148

COc1ccccc1C(=O)Nc1ccc(-c2oc(-c3ccccc3)nc2C(=O)NCc2ccccc2C(F)(F)F)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGES O14684 7/20 0.49
MAPT P10636 3/20 0.48
KDM4E B2RXH2 2/20 0.48
HPGD P15428 2/20 0.48
NPC1 O15118 1/20 0.48
ALDH1A1 P00352 1/20 0.48
RAB9A P51151 1/20 0.48
HSD17B10 Q99714 1/20 0.48
THRB P10828 2/20 0.47
TP53 P04637 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
LMNA P02545 1/20 0.44
DGAT1 O75907 5/20 0.44
SMO Q99835 1/20 0.43
S1PR1 P21453 1/20 0.43

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
SCHEMBL7699225 0.89 PTGES (0.53) PTGESCNR1CNR2DGAT1SMO
SCHEMBL7696332 0.88 PTGES (0.49) PTGESMAPTKDM4EHPGDNPC1
SCHEMBL7696456 0.87 MAPT (0.51) MAPTRAB9ATHRBTP53LMNA
SCHEMBL7700202 0.86 EPHX2 (0.52) PTGESNPC1RAB9AHSD17B10TP53
SCHEMBL7693795 0.86 KDM4E (0.51) PTGESKDM4ENPC1ALDH1A1RAB9A
SCHEMBL7693770 0.85 TSHR (0.50) MAPTKDM4EHPGDNPC1ALDH1A1
SCHEMBL7701384 0.85 EPHX2 (0.51) PTGESMAPTKDM4EHPGDALDH1A1
SCHEMBL7693811 0.85 NPC1 (0.50) PTGESKDM4EHPGDNPC1ALDH1A1
SCHEMBL7700947 0.85 KDM4E (0.47) PTGESKDM4ENPC1ALDH1A1RAB9A
SCHEMBL7700054 0.85 NPC1 (0.50) PTGESMAPTKDM4EHPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002064558-A2 OXAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS CYTOKINE INHIBITORS SANKYO COMPANY, LIMITED (JP) 2002-08-22 WO disclosed