SCHEMBL7703553

SCHEMBL7703553

CSc1ccccc1NC(=O)c1nc(-c2ccc(C(C)(C)C)cc2)oc1-c1ccc(NC(C)=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
GAA P10253 1/20 0.49
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
IKBKB O14920 2/20 0.44
TRPV1 Q8NER1 1/20 0.43
TP53 P04637 5/20 0.40
KMT2A Q03164 3/20 0.40
HSD17B10 Q99714 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 4/20 0.39
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 2/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
HPGD P15428 1/20 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
SCHEMBL7701004 0.91 KDM4E (0.59) KDM4EGAANPC1RAB9AKMT2A
SCHEMBL7695211 0.88 KDM4E (0.53) KDM4EGAANPC1RAB9AIKBKB
SCHEMBL7703337 0.87 GAA (0.49) KDM4EGAANPC1RAB9AIKBKB
SCHEMBL7703333 0.86 KDM4E (0.64) KDM4EGAANPC1RAB9AIKBKB
SCHEMBL7699576 0.86 KDM4E (0.48) KDM4EGAANPC1RAB9AIKBKB
SCHEMBL7703211 0.84 KDM4E (0.49) KDM4EGAANPC1RAB9AIKBKB
SCHEMBL7693822 0.83 NR1H4 (0.48) KDM4EGAANPC1RAB9AIKBKB
SCHEMBL7693950 0.82 IKBKB (0.52) KDM4EGAAIKBKBTRPV1TP53
SCHEMBL7699894 0.81 IKBKB (0.54) KDM4EGAANPC1RAB9AIKBKB
SCHEMBL7699245 0.81 KDM4E (0.52) KDM4EGAANPC1RAB9AKMT2A

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