SCHEMBL14219490

SCHEMBL14219490

C[C@@H](Cc1ccc(CCC2CCC(c3ccc(Cl)cc3)CC2)cc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CCR1 P32246 7/20 0.39
IDO1 P14902 1/20 0.39
MAOB P27338 2/20 0.38
BCL2L1 Q07817 1/20 0.38
MCL1 Q07820 1/20 0.38
LSS P48449 1/20 0.36
CHRM4 P08173 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
TACR1 P25103 1/20 0.36

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
SCHEMBL14219435 1.00 MEN1 (0.41) MEN1KMT2ACCR1IDO1MAOB
SCHEMBL14219981 1.00 MEN1 (0.41) MEN1KMT2ACCR1IDO1MAOB
SCHEMBL14219588 0.88 POLB (0.41) MAOB
SCHEMBL14219935 0.88 POLB (0.41) MAOB
SCHEMBL14219983 0.88 POLB (0.41) MAOB
SCHEMBL14219941 0.85 GRM2 (0.34) MEN1KMT2AIDO1MAOB
SCHEMBL14219960 0.85 GRM2 (0.34) MEN1KMT2AIDO1MAOB
SCHEMBL14219926 0.85 HCRTR1 (0.38)
SCHEMBL14219988 0.85 HCRTR1 (0.34) MAOB
SCHEMBL14219956 0.85 HCRTR1 (0.38)

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
EP-1650285-B1 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEM KK (JP) 2008-04-30 EP disclosed