SCHEMBL9836396

SCHEMBL9836396

Clc1ccc2c(c1)ncc1nc(-c3cccs3)[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.45
HPGD P15428 6/20 0.45
ALDH1A1 P00352 6/20 0.45
MAPT P10636 3/20 0.45
GAA P10253 3/20 0.45
GLA P06280 2/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45
NPC1 O15118 6/20 0.45
RAB9A P51151 5/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
HSD17B10 Q99714 3/20 0.45
PKM P14618 1/20 0.44
TP53 P04637 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
ADORA3 P0DMS8 1/20 0.40
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
SCHEMBL6420845 0.77 ALDH1A1 (0.65) KDM4EHPGDALDH1A1MAPTGAA
SCHEMBL10771438 0.74 KDM4E (0.44) KDM4EHPGDALDH1A1MAPTGAA
SCHEMBL10771178 0.68 TNKS (0.58) KDM4EHPGDALDH1A1MAPTMEN1
SCHEMBL28184296 0.66 PDGFRB (0.58) KDM4EHPGDALDH1A1MAPTGAA
SCHEMBL31305431 0.66 SMPD3 (0.46) KDM4EHPGDALDH1A1MAPTGAA
SCHEMBL14060083 0.66 SMPD3 (0.46) KDM4EHPGDALDH1A1MAPTGAA
SCHEMBL18042289 0.65 KDM4E (0.52) KDM4EHPGDALDH1A1MAPTGAA
SCHEMBL914097 0.65 ALDH1A1 (0.81) KDM4EHPGDALDH1A1MAPTGAA
SCHEMBL8068757 0.64 GBA1 (0.47) KDM4EHPGDALDH1A1MAPTGAA
SCHEMBL1147594 0.64 KDM4E (0.65) KDM4EHPGDALDH1A1MAPTGAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0223420-B1 CONDENSED IMIDAZOPYRIDINE DERIVATIVES SHIONOGI & CO., LTD. (JP) 1991-02-27 EP claimed
US-4753951-A ANTIDEPRESSANTS, ANXIOLYTICS SHIONOGI & CO., LTD. (JP) 1988-06-28 US claimed
EP-0223420-A1 Condensed imidazopyridine derivatives SHIONOGI & CO., LTD. (JP) 1987-05-27 EP claimed