SCHEMBL14337145

SCHEMBL14337145

Cc1c(N)cc(C#N)c(N)c1N

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.35
KMT2A Q03164 3/20 0.35
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
LMNA P02545 2/20 0.35
GAA P10253 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HTT P42858 2/20 0.35
HPGD P15428 1/20 0.35
ALDH1A1 P00352 4/20 0.34
USP2 O75604 1/20 0.34
XDH P47989 1/20 0.34
TDP1 Q9NUW8 3/20 0.33
CYP3A4 P08684 3/20 0.33
TSHR P16473 2/20 0.33
TP53 P04637 2/20 0.33
MBOAT4 Q96T53 2/20 0.32
ADRB2 P07550 2/20 0.31
ADRB1 P08588 1/20 0.31
THRB P10828 2/20 0.31

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
SCHEMBL7951303 0.78 KDM4E (0.38) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL24713060 0.75 KDM4E (0.42) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL9475769 0.73 XDH (0.41) KDM4EKMT2AMAPTSMN1; SMN2HTT
SCHEMBL25982008 0.73 TSHR (0.38) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL10935150 0.73 KDM4E (0.42) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL18851517 0.73 KDM4E (0.35) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL6630371 0.72 KDM4E (0.43) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL240599 0.72 KDM4E (0.48) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL29420723 0.72 KDM4E (0.48) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL1796492 0.71 CD44 (0.42) KDM4EKMT2AMAPTMEN1LMNA

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
US-7304084-B2 6-[(4,5-Dihydro-1H-imidazol-2-yl)amino]-7-methyl-1H-benzimidazole-4-carbonitrile and its preferred salt THE BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 2007-12-04 US disclosed