SCHEMBL17570840

SCHEMBL17570840

c1ccc2nc3c(nc2c1)[nH]c1nc2ccccc2n13

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.49
ALDH1A1 P00352 8/20 0.49
HPGD P15428 7/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
HSD17B10 Q99714 4/20 0.47
LMNA P02545 3/20 0.47
RAB9A P51151 3/20 0.47
MAPT P10636 3/20 0.47
TP53 P04637 2/20 0.47
NPC1 O15118 2/20 0.47
GAA P10253 1/20 0.47
PKM P14618 1/20 0.47
RPA1 P27694 1/20 0.44
ZAP70 P43403 1/20 0.44
MAPK10 P53779 1/20 0.43
POLB P06746 1/20 0.42
ADORA1 P30542 2/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ADORA2A P29274 1/20 0.40

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
SCHEMBL23504053 0.80 KDM4E (0.47) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL20929343 0.77 KDM4E (0.57) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL21101673 0.75 ALDH1A1 (0.48) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL1698065 0.73 KDM4E (0.53) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL21101501 0.72 KDM4E (0.46) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL23504050 0.72 KDM4E (0.46) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL11697748 0.69 KDM4E (0.56) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL17570857 0.69 KDM4E (0.46) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL17570856 0.69 KDM4E (0.46) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL2707132 0.68 RPA1 (0.50) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10

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
EP-2993215-B1 Azabenzimidazo[2,1-a]benzimidazoles for electronic applications IDEMITSU KOSAN CO (JP) 2019-06-19 EP disclosed
EP-2993215-A1 Azabenzimidazo[2,1-a]benzimidazoles for electronic applications Idemitsu Kosan Co., Ltd. (JP) 2016-03-09 EP disclosed