SCHEMBL20217438

SCHEMBL20217438

CCCc1ccc(C(=N)c2cc(C(=O)NCc3ccccn3)ccc2N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
HPGD P15428 2/20 0.50
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
LMNA P02545 2/20 0.47
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
POLB P06746 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CA2 P00918 1/20 0.47
NAMPT P43490 1/20 0.45
MAPK14 Q16539 1/20 0.45
ALDH1A1 P00352 3/20 0.44
HTT P42858 3/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL20217165 0.83 KDM4E (0.58) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL14393413 0.83 HPGD (0.69) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL20217538 0.81 KMT2A (0.44) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL20217652 0.78 TAS1R3 (0.40) KMT2ALMNARAB9ANPC1POLB
SCHEMBL20217247 0.78 KMT2A (0.48) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL20217423 0.77 KDM4E (0.40) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL20217432 0.77 KMT2A (0.47) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL20217630 0.77 RAB9A (0.45) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL20217804 0.77 RAB9A (0.43) KDM4EMEN1KMT2ALMNARAB9A
SCHEMBL20217401 0.77 KDM4E (0.44) KDM4EMEN1KMT2ALMNARAB9A

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-2766352-B1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIV HEALTH NETWORK UHN (CA) 2018-06-06 EP disclosed