SCHEMBL21646321

SCHEMBL21646321

Nc1ccc2c(c1-c1cccc3c1CCCC3)CCCC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.44
BAD Q92934 1/20 0.44
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
NOS3 P29474 2/20 0.38
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38
PARP1 P09874 1/20 0.38
CES1 P23141 5/20 0.37
TSHR P16473 1/20 0.37
CCNE2 O96020 1/20 0.35
CCNE1 P24864 1/20 0.35
CDK2 P24941 1/20 0.35
GRIN2D O15399 1/20 0.35

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
SCHEMBL8402725 0.82 NOS3 (0.47) BCL2L1BADMEN1KMT2AKDM4E
SCHEMBL1556631 0.79 BCL2L1 (0.58) BCL2L1BADMEN1KMT2AKDM4E
SCHEMBL29488427 0.79 BCL2L1 (0.58) BCL2L1BADMEN1KMT2AKDM4E
SCHEMBL7104248 0.79 BCL2L1 (0.44) BCL2L1BADMEN1KMT2AHPGD
SCHEMBL4974372 0.78 BCL2L1 (0.60) BCL2L1BADMEN1KMT2AKDM4E
SCHEMBL8517456 0.77 AURKA (0.42) BCL2L1BADMEN1KMT2AKDM4E
Bromide SCHEMBL7104246 0.76 BCL2L1 (0.58) BCL2L1BADMEN1KMT2AKDM4E
SCHEMBL4358490 0.76 BCL2L1 (0.48) BCL2L1BADMEN1KMT2AKDM4E
SCHEMBL15303988 0.75 BCL2L1 (0.41) BCL2L1BADMEN1KMT2AKDM4E
SCHEMBL14930999 0.75 DRD2 (0.48) BCL2L1BADMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4234522-A2 PRODUCTION OF FATTY OLEFIN DERIVATIVES VIA OLEFIN METATHESIS Provivi, Inc. (US) 2023-08-30 EP disclosed
WO-2020018581-A1 SYNTHESIS OF STRAIGHT-CHAIN LEPIDOPTERAN PHEROMONES THROUGH ONE- OR TWO- CARBON HOMOLOGATION OF FATTY ALKENES PROVIVI, INC. (US) 2020-01-23 WO disclosed