SCHEMBL3430643

SCHEMBL3430643

Cc1[c]ncc(Cl)c1C#N

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 3/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
RECQL P46063 1/20 0.30
GLA P06280 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL15052376 0.79 RECQL (0.35) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL22289685 0.72
SCHEMBL3430642 0.72 KDM4E (0.33) ALDH1A1KDM4EL3MBTL1MEN1KMT2A
SCHEMBL10260750 0.67 KDM4E (0.35) ALDH1A1KDM4EL3MBTL1MEN1KMT2A
SCHEMBL558164 0.67 TSHR (0.37) ALDH1A1TSHR
SCHEMBL193133 0.66 ALDH1A1 (0.39) ALDH1A1KDM4EL3MBTL1MEN1KMT2A
SCHEMBL1967465 0.65 KDM4E (0.35) ALDH1A1KDM4EL3MBTL1MEN1KMT2A
SCHEMBL1679899 0.63
SCHEMBL3430041 0.62 SRC (0.35) ALDH1A1KDM4ERECQL
SCHEMBL2912781 0.61 ALDH1A1 (0.46) ALDH1A1KDM4EL3MBTL1MEN1KMT2A

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
WO-2010146351-A1 INDOLYLMETHYL-MORPHOLINE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2010-12-23 WO disclosed