SCHEMBL7703211

SCHEMBL7703211

CC(=O)Nc1ccc(-c2oc(-c3ccc(C(C)(C)C)cc3)nc2C(=O)Nc2ccccc2Cc2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.49
GAA P10253 1/20 0.49
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
NR1H4 Q96RI1 2/20 0.42
IKBKB O14920 1/20 0.42
TRPV1 Q8NER1 2/20 0.41
DGAT1 O75907 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
ALDH1A1 P00352 2/20 0.40
ADRB2 P07550 1/20 0.40
HPGD P15428 1/20 0.40
MAOB P27338 1/20 0.40
EPHX2 P34913 1/20 0.40
STAT3 P40763 1/20 0.40
POLB P06746 2/20 0.39
CASP3 P42574 2/20 0.39
SENP8 Q96LD8 2/20 0.39

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
SCHEMBL7696393 0.93 KDM4E (0.57) KDM4EGAANPC1RAB9ADGAT1
SCHEMBL7703333 0.86 KDM4E (0.64) KDM4EGAANPC1RAB9AIKBKB
SCHEMBL7695211 0.85 KDM4E (0.53) KDM4EGAANPC1RAB9ANR1H4
SCHEMBL7703553 0.84 KDM4E (0.49) KDM4EGAANPC1RAB9AIKBKB
SCHEMBL7703337 0.84 GAA (0.49) KDM4EGAANPC1RAB9AIKBKB
SCHEMBL7699576 0.84 KDM4E (0.48) KDM4EGAANPC1RAB9ANR1H4
SCHEMBL7699894 0.80 IKBKB (0.54) KDM4EGAANPC1RAB9ANR1H4
SCHEMBL7699245 0.80 KDM4E (0.52) KDM4EGAANPC1RAB9ANR1H4
SCHEMBL7693950 0.80 IKBKB (0.52) KDM4EGAANR1H4IKBKBTRPV1
SCHEMBL7698294 0.80 MEN1 (0.52) KDM4EGAANPC1RAB9ASMN1; SMN2

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