SCHEMBL7700128

SCHEMBL7700128

O=C(Nc1ccc(-c2oc(-c3ccccc3)nc2C(=O)NCc2ccccc2C(F)(F)F)cc1)c1cccc(F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 9/20 0.49
PPARG P37231 5/20 0.46
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PTGES O14684 1/20 0.44
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
GRK3 P35626 2/20 0.43
ROCK2 O75116 2/20 0.43
PRKCA P17252 2/20 0.43
GRK2 P25098 2/20 0.43
PRKD3 O94806 1/20 0.43
PRKCG P05129 1/20 0.43
PRKCB P05771 1/20 0.43
PRKCH P24723 1/20 0.43
GRK5 P34947 1/20 0.43
PRKCI P41743 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
SCHEMBL7700202 0.92 EPHX2 (0.52) EPHX2PPARGTP53PTGESMEN1
SCHEMBL7701450 0.91 EPHX2 (0.48) EPHX2PPARGTP53MAPTSMN1; SMN2
SCHEMBL7701384 0.91 EPHX2 (0.51) EPHX2PPARGTP53MAPTSMN1; SMN2
SCHEMBL7693770 0.89 TSHR (0.50) EPHX2TP53MAPTSMN1; SMN2MEN1
SCHEMBL7699756 0.87 EPHX2 (0.48) EPHX2MAPTSMN1; SMN2PTGESGRK3
SCHEMBL7703699 0.87 ALDH1A1 (0.51) EPHX2MAPTSMN1; SMN2PTGESMEN1
SCHEMBL7696332 0.86 PTGES (0.49) EPHX2TP53MAPTSMN1; SMN2PTGES
SCHEMBL7693795 0.85 KDM4E (0.51) EPHX2TP53SMN1; SMN2PTGESMEN1
SCHEMBL7701962 0.85 TAOK1 (0.54) EPHX2PPARGTP53MAPTSMN1; SMN2
SCHEMBL7696456 0.85 MAPT (0.51) EPHX2TP53MAPTMEN1RAB9A

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