SCHEMBL9634280

SCHEMBL9634280

C#CCOc1cc(-c2nc3cnccc3[nH]2)ccc1OCC

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.48
ALDH1A1 P00352 3/20 0.47
HPGD P15428 3/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPT P10636 4/20 0.47
S1PR1 P21453 7/20 0.44
PDE10A Q9Y233 1/20 0.41
S1PR3 Q99500 2/20 0.41
HSD17B10 Q99714 2/20 0.40
TOP1 P11387 1/20 0.40
TOP2A P11388 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GUSB P08236 1/20 0.39
MAOA P21397 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
SCHEMBL9636115 1.00 MAOB (0.48) MAOBALDH1A1HPGDKDM4EMAPT
SCHEMBL10845975 0.91 ALDH1A1 (0.55) ALDH1A1HPGDKDM4EMAPTS1PR1
SCHEMBL9634345 0.90 KDM4E (0.60) MAOBALDH1A1HPGDKDM4ETOP1
SCHEMBL9634508 0.90 KDM4E (0.60) MAOBALDH1A1HPGDKDM4ETOP1
Hydrochloric Acid SCHEMBL10847302 0.90 ALDH1A1 (0.57) ALDH1A1HPGDKDM4EMAPTS1PR1
SCHEMBL9634312 0.88 KDM4E (0.41) MAOBALDH1A1HPGDKDM4EMAPT
SCHEMBL9635537 0.87 ALDH1A1 (0.43) MAOBALDH1A1HPGDKDM4EMAPT
SCHEMBL9634834 0.85 ALDH1A1 (0.44) ALDH1A1HPGDKDM4ETOP1TOP2A
SCHEMBL9636238 0.83 MAPT (0.43) MAOBALDH1A1HPGDKDM4EMAPT
SCHEMBL9634938 0.83 PDE10A (0.40) MAOBALDH1A1PDE10AKMT2AGUSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5104881-A 2-ARYLIMIDAZOPYRIDINES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-04-14 US disclosed
US-4616090-A 2-arylimidazopyridines intermediates MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1986-10-07 US disclosed
EP-0072926-B1 2-ARYLIMIDAZOPYRIDINES MERCK PATENT GmbH (DE) 1986-09-24 EP disclosed
EP-0072926-A1 2-Arylimidazopyridines MERCK PATENT GmbH (DE) 1983-03-02 EP disclosed