SCHEMBL7698646

SCHEMBL7698646

Cc1cc(NC(=O)c2nc(-c3ccccc3-c3ccccc3)oc2-c2ccc(N(C)C)cc2)no1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.46
NPC1 O15118 6/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
LMNA P02545 3/20 0.45
GBA1 P04062 1/20 0.45
TSHR P16473 1/20 0.45
KDM4E B2RXH2 5/20 0.44
RXFP1 Q9HBX9 1/20 0.44
HTT P42858 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 2/20 0.42
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
USP2 O75604 1/20 0.40
KDR P35968 1/20 0.40
PDE4B Q07343 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
SCHEMBL7699604 0.85 MAPT (0.47) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL7698114 0.84 MAPT (0.48) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL7695132 0.84 MAPT (0.49) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL7699148 0.83 MAPT (0.48) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL7699046 0.82 POLB (0.45) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL7695160 0.80 MAPT (0.41) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL7694375 0.80 HSD17B10 (0.40) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL7695678 0.80 CHRNB2 (0.49) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL7699090 0.80 MAPT (0.40) MEN1KMT2ASMN1; SMN2LMNATSHR
SCHEMBL7698104 0.79 MAPT (0.51) RAB9AMEN1KMT2ALMNATSHR

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