SCHEMBL11375265

SCHEMBL11375265

Cc1ccccc1C(=O)NC(=O)Nc1cnc(-c2ccc(Br)cc2)c(C)n1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.51
NPC1 O15118 9/20 0.51
MAPK1 P28482 2/20 0.51
TP53 P04637 2/20 0.51
ALDH1A1 P00352 4/20 0.48
LMNA P02545 3/20 0.47
MAPT P10636 2/20 0.47
TRPV1 Q8NER1 1/20 0.42
ALOX15 P16050 1/20 0.40
HTT P42858 1/20 0.40
KDM4E B2RXH2 3/20 0.40
HPGD P15428 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
PTGFR P43088 1/20 0.38
STAT1 P42224 1/20 0.37

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
SCHEMBL11381909 0.91 ALDH1A1 (0.44) RAB9ANPC1MAPK1TP53ALDH1A1
SCHEMBL7628324 0.89 PCTP (0.42) RAB9ANPC1MAPK1TP53ALDH1A1
SCHEMBL11524059 0.88 TRPV1 (0.42) RAB9ANPC1MAPK1TP53ALDH1A1
SCHEMBL11380577 0.87 NPC1 (0.49) RAB9ANPC1MAPK1TP53ALDH1A1
SCHEMBL11370198 0.86 TRPV1 (0.45) RAB9ANPC1MAPK1TP53ALDH1A1
SCHEMBL11522579 0.82 MEN1 (0.41) RAB9ANPC1ALDH1A1MAPTTRPV1
SCHEMBL3665409 0.82 MAPT (0.38) RAB9ANPC1ALDH1A1LMNAMAPT
SCHEMBL11371270 0.80 SMO (0.47) RAB9ANPC1ALDH1A1
SCHEMBL11379838 0.80 CNR1 (0.46) RAB9ANPC1MAPK1ALDH1A1LMNA
SCHEMBL11373545 0.80 CNR1 (0.44) RAB9ANPC1TP53ALDH1A1LMNA

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
US-4293552-A Novel 1-(mono-o-substituted benzoyl)-3-(substituted pyrazinyl) ureas ELI LILLY AND COMPANY (US) 1981-10-06 US disclosed