SCHEMBL8699491

SCHEMBL8699491

Cc1nccn1CCC1CCCCN1C(=O)CCCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.62
RAB9A P51151 3/20 0.62
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
BLM P54132 1/20 0.57
HPGD P15428 1/20 0.48
KDM4E B2RXH2 1/20 0.42
MAPK1 P28482 1/20 0.42
TP53 P04637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PREP P48147 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
SCHEMBL8696612 0.94 BLM (0.61) NPC1RAB9AMEN1KMT2ABLM
SCHEMBL8698720 0.86 BLM (0.61) NPC1RAB9AMEN1KMT2ABLM
SCHEMBL8698349 0.83 BLM (0.52) NPC1RAB9AMEN1KMT2ABLM
SCHEMBL8701038 0.83 NPC1 (0.54) NPC1RAB9AMEN1KMT2ABLM
SCHEMBL8697813 0.82 NPC1 (0.51) NPC1RAB9AMEN1KMT2ABLM
SCHEMBL8701671 0.82 ADRA2A (0.42) MEN1KMT2ABLM
SCHEMBL8545094 0.81 F10 (0.57) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL8701243 0.80 NPC1 (0.62) NPC1RAB9AMEN1KMT2AHPGD
SCHEMBL8701544 0.78 NPC1 (0.53) NPC1RAB9AMEN1KMT2ABLM
SCHEMBL8699938 0.77 NPC1 (0.54) NPC1RAB9AMEN1KMT2AHPGD

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-5741800-A ANTIINFLAMMATORY AGENT, ANTIALLERGENS KNOLL AKTIENGESELLACHAFT (DE) 1998-04-21 US disclosed