SCHEMBL7699326

SCHEMBL7699326

CCCNC(=O)c1nc(-c2ccc(C(C)(C)C)cc2)oc1-c1ccc(NC(C)=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 2/20 0.47
KDM4E B2RXH2 2/20 0.45
GAA P10253 1/20 0.45
EPHX2 P34913 1/20 0.45
NR1H4 Q96RI1 1/20 0.45
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
POLB P06746 2/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
MAPT P10636 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 2/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TRPV1 Q8NER1 1/20 0.41
ALDH1A1 P00352 1/20 0.40
ADRB2 P07550 1/20 0.40

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
SCHEMBL7695163 0.89 KDM4E (0.58) KDM4EGAANPC1RAB9APOLB
SCHEMBL7701097 0.86 KDM4E (0.47) IKBKBKDM4EGAAEPHX2NR1H4
SCHEMBL7704952 0.84 SMN1; SMN2 (0.44) IKBKBKDM4EGAAEPHX2NR1H4
SCHEMBL7695247 0.84 EPHX2 (0.54) IKBKBKDM4EGAAEPHX2NR1H4
SCHEMBL7699894 0.84 IKBKB (0.54) IKBKBKDM4EGAAEPHX2NR1H4
SCHEMBL7703035 0.84 MAPT (0.50) IKBKBKDM4EGAAEPHX2NR1H4
SCHEMBL7703333 0.83 KDM4E (0.64) IKBKBKDM4EGAANPC1RAB9A
SCHEMBL7693950 0.83 IKBKB (0.52) IKBKBKDM4EGAAEPHX2NR1H4
SCHEMBL7701315 0.83 MTNR1A (0.45) IKBKBKDM4EGAANPC1RAB9A
SCHEMBL7697412 0.82 TARBP2 (0.49) IKBKBKDM4EGAANPC1RAB9A

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