SCHEMBL1697448

SCHEMBL1697448

CC(=O)n1c(Br)cc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.50
NOTUM Q6P988 1/20 0.46
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
MCL1 Q07820 1/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
LMNA P02545 2/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
DAO P14920 2/20 0.41
TUBB4A P04350 2/20 0.40
TUBB P07437 2/20 0.40
TUBA3C P0DPH7 2/20 0.40
TUBA1B P68363 2/20 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
SCHEMBL17075022 0.81 L3MBTL1 (0.47) POLBMTNR1AMTNR1BMCL1L3MBTL1
SCHEMBL28548039 0.79 POLB (0.52) POLBNOTUMMCL1NPC1RAB9A
SCHEMBL17022579 0.79 POLB (0.52) POLBNOTUMMCL1NPC1RAB9A
SCHEMBL28033181 0.78 POLB (0.50) POLBNOTUMMCL1NPC1RAB9A
SCHEMBL6072599 0.78 POLB (0.50) POLBNOTUMMCL1NPC1RAB9A
SCHEMBL23168121 0.77 POLB (0.46) POLBNOTUMMCL1NPC1RAB9A
SCHEMBL5599682 0.77 NR1H2 (0.56)
SCHEMBL4222282 0.76 MCL1 (0.64) POLBNOTUMMCL1KDM4EALDH1A1
SCHEMBL6208706 0.75 POLB (0.47) POLBNOTUMMCL1NPC1RAB9A
SCHEMBL13940630 0.75 ALDH1A1 (0.60) POLBMTNR1AMTNR1BL3MBTL1KDM4E

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-2012004811-A1 PROCESS FOR THE PREPARATION OF 5-SUBSTSITUTED INDOLE DERIVATIVE IND-SWIFT LABORATORIES LIMITED (IN) 2012-01-12 WO disclosed