SCHEMBL3462830

SCHEMBL3462830

NC(=O)c1ccccc1C(=O)c1ncc[nH]1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.67
CSNK1A1 P48729 1/20 0.58
TYRO3 Q06418 1/20 0.58
DYRK1B Q9Y463 1/20 0.58
HTT P42858 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
GLA P06280 1/20 0.53
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
F2RL1 P55085 1/20 0.46
NUDT1 P36639 1/20 0.44
PARP1 P09874 3/20 0.43
ALDH1A1 P00352 2/20 0.40
PDPK1 O15530 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
METAP2 P50579 1/20 0.38

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
SCHEMBL27805818 0.91 KMT2A (0.77) KMT2ACSNK1A1TYRO3DYRK1BHTT
SCHEMBL2450877 0.85 KMT2A (0.69) KMT2ACSNK1A1TYRO3DYRK1BHTT
SCHEMBL653632 0.80 KMT2A (0.67) KMT2ACSNK1A1TYRO3DYRK1BHTT
SCHEMBL28358852 0.80 KMT2A (0.67) KMT2ACSNK1A1TYRO3DYRK1BHTT
SCHEMBL395690 0.80 KMT2A (0.67) KMT2ACSNK1A1TYRO3DYRK1BHTT
SCHEMBL11816392 0.80 KMT2A (0.61) KMT2AHTTSMN1; SMN2GLANPC1
SCHEMBL29212534 0.78 CSNK1A1 (0.59) KMT2ACSNK1A1TYRO3DYRK1BHTT
SCHEMBL7193170 0.78 KMT2A (0.63) KMT2AHTTSMN1; SMN2GLANPC1
Biphenyl SCHEMBL27718930 0.76 CSNK1A1 (0.49) KMT2ACSNK1A1TYRO3DYRK1BHTT
SCHEMBL34651 0.76

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
US-7795448-B2 Imidazoyl-benzamide anti-cancer agents CYTOKINETICS, INCORPORATED (US) 2010-09-14 US disclosed
US-7582668-B2 Imidazoyl-benzamide anti-cancer agents CYTOKINETICS, INCORPORATED (US) 2009-09-01 US disclosed