SCHEMBL11047787

SCHEMBL11047787

COc1ccccc1C(=O)c1c[nH]cn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.54
RAB9A P51151 4/20 0.45
CTSD P07339 1/20 0.44
NPC1 O15118 3/20 0.43
MEN1 O00255 1/20 0.43
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ESRRA P11474 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RXFP1 Q9HBX9 1/20 0.42
STAT3 P40763 1/20 0.42
RORC P51449 1/20 0.42
RORB Q92753 1/20 0.42
STS P08842 1/20 0.42
BRD4 O60885 1/20 0.41
CDK5 Q00535 1/20 0.41
CDK5R1 Q15078 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.41

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
SCHEMBL5688780 0.83 RAB9A (0.47) CNR2RAB9AMEN1KMT2A
SCHEMBL30214751 0.81 FLT1 (0.44) RAB9ANPC1MEN1KMT2A
SCHEMBL11049928 0.80 ALDH1A1 (0.43) RAB9ANPC1ESRRA
SCHEMBL11056739 0.77 CLCN2 (0.35) NPSR1
SCHEMBL9525840 0.76 RAB9A (0.71) CNR2RAB9ANPC1MEN1TP53
SCHEMBL30118936 0.76 RAB9A (0.71) CNR2RAB9ANPC1MEN1TP53
SCHEMBL322168 0.76 CTSD (0.62) CNR2RAB9ACTSDNPC1SMN1; SMN2
SCHEMBL29658169 0.76 CTSD (0.62) CNR2RAB9ACTSDNPC1SMN1; SMN2
SCHEMBL27789892 0.74 CTSD (0.60) CNR2RAB9ACTSDNPC1SMN1; SMN2
SCHEMBL5689131 0.73 SYK (0.45) MEN1GAAKMT2ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US claimed
EP-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP disclosed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US disclosed