SCHEMBL12473545

SCHEMBL12473545

CC1(C)C(=O)N(C2C3CC4CC5CC2CC45C3)N1C(=O)c1cccc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
HCRTR1 O43613 1/20 0.37
HCRTR2 O43614 1/20 0.37
CCR5 P51681 2/20 0.36
KDM4E B2RXH2 1/20 0.36
CBX7 O95931 1/20 0.35
CDY1; CDY1B Q9Y6F8 1/20 0.35
ALDH1A1 P00352 2/20 0.35
GAA P10253 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
FFAR2 O15552 1/20 0.35
AVPR1A P37288 1/20 0.34
CDYL Q9Y232 1/20 0.34
TACR1 P25103 1/20 0.34
BCHE P06276 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL2170041 0.86 KMT2A (0.40) KMT2AHCRTR1HCRTR2CCR5CBX7
SCHEMBL13368960 0.82 RAB9A (0.40) KMT2AKDM4ECBX7CDY1; CDY1BLMNA
SCHEMBL13368858 0.81 MT-CO2 (0.33) HCRTR1HCRTR2GAA
SCHEMBL13368845 0.78 ELANE (0.38) KMT2AKDM4ECBX7CDY1; CDY1BALDH1A1
SCHEMBL2169721 0.77 CNR2 (0.45) KMT2ACCR5KDM4ECBX7CDY1; CDY1B
SCHEMBL12473228 0.72 HPGD (0.42) KMT2AALDH1A1GAAPOLBMEN1
SCHEMBL2169693 0.71 ITGB1 (0.42) KMT2ACCR5ALDH1A1POLBHTT
SCHEMBL2172271 0.71 KDM4E (0.39) KMT2AKDM4EALDH1A1GAALMNA
SCHEMBL2170594 0.70 USP2 (0.36) KDM4EALDH1A1GAAPOLB
SCHEMBL2170645 0.70 GAA (0.45) HCRTR1HCRTR2ALDH1A1GAALMNA

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-2348019-A1 1,2-DIAZETIDIN-3-ONE DERIVATIVE AND PHARMACEUTICAL AGENT COMPRISING SAME Kowa Company, Ltd. (JP) 2011-07-27 EP disclosed
WO-2010050191-A1 1,2-DIAZETIDIN-3-ONE DERIVATIVE AND PHARMACEUTICAL AGENT COMPRISING SAME 興和株式会社 (JP) 2010-05-06 WO disclosed