SCHEMBL7429237

SCHEMBL7429237

CCOc1cc[c]c2cccc(OCC)c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
KDM4E B2RXH2 3/20 0.42
GRK6 P43250 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
PABPC1 P11940 1/20 0.42
L3MBTL1 Q9Y468 6/20 0.41
POLB P06746 2/20 0.41
RECQL P46063 2/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 3/20 0.41
NPSR1 Q6W5P4 2/20 0.37
GLA P06280 1/20 0.37
CYP2A6 P11509 1/20 0.36
NPC1 O15118 1/20 0.35
MAPK1 P28482 1/20 0.35
RAD52 P43351 1/20 0.35
RAB9A P51151 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
SCHEMBL646684 0.79 CA1 (0.42) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL40509 0.78 ALDH1A1 (0.41) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL2232272 0.76 CYP2A6 (0.41) MAPTMEN1KMT2AKDM4EGRK6
SCHEMBL7774117 0.72
SCHEMBL3826271 0.71 MAPT (0.50) MAPTMEN1KMT2AKDM4EGRK6
SCHEMBL2251995 0.69 TLR8 (0.40) MEN1KMT2AKDM4ETDP1L3MBTL1
SCHEMBL3223156 0.69 ALDH1A1 (0.44) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL18417214 0.68 MAPT (0.47) MAPTMEN1KMT2AKDM4EGRK6
SCHEMBL10970049 0.68 DAO (0.32) MAPTMEN1KMT2AKDM4EL3MBTL1
SCHEMBL7289074 0.68 DAO (0.41) MAPTMEN1KMT2AKDM4EGRK6

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
EP-0283310-B1 N-BENZHYDRYL-SUBSTITUTED HETEROCYCLIC DERIVATIVES, THEIR PREPARATION AND THEIR USE Sankyo Company Limited (JP) 1993-05-26 EP disclosed
US-5028610-A Calcium Channel Blockers SANKYO COMPANY LIMITED (JP) 1991-07-02 US disclosed
EP-0283310-A1 N-Benzhydryl-substituted heterocyclic derivatives, their preparation and their use Sankyo Company Limited (JP) 1988-09-21 EP disclosed