SCHEMBL9634643

SCHEMBL9634643

C#CCOc1cccc(-c2nc3cnccc3[nH]2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.49
MAOA P21397 3/20 0.46
HDAC3 O15379 7/20 0.43
HDAC4 P56524 7/20 0.43
HDAC1 Q13547 7/20 0.43
HDAC7 Q8WUI4 7/20 0.43
HDAC2 Q92769 7/20 0.43
HDAC10 Q969S8 7/20 0.43
HDAC11 Q96DB2 7/20 0.43
HDAC8 Q9BY41 7/20 0.43
HDAC6 Q9UBN7 7/20 0.43
HDAC9 Q9UKV0 7/20 0.43
HDAC5 Q9UQL6 7/20 0.43
CYP1A1 P04798 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP1B1 Q16678 1/20 0.43
TOP1 P11387 1/20 0.42
TOP2A P11388 1/20 0.42
KDM4E B2RXH2 3/20 0.42
NPC1 O15118 2/20 0.42

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
SCHEMBL9636045 0.88 HDAC6 (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10736317 0.86 MAOB (0.51) MAOBMAOAHDAC3HDAC4HDAC1
SCHEMBL9636316 0.85 CYP1A1 (0.55) MAOBMAOAHDAC3HDAC4HDAC1
SCHEMBL9635672 0.84 MAPT (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL9634597 0.84 FGFR1 (0.42) MAOBMAOACYP1A1CYP1A2CYP1B1
SCHEMBL9636238 0.84 MAPT (0.43) MAOBMAOACYP1A1CYP1A2CYP1B1
SCHEMBL9634295 0.83 HDAC6 (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL9634499 0.82 HDAC6 (0.49) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL9636105 0.81 HDAC6 (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL9634591 0.81 TOP1 (0.40) MAOBMAOACYP1A1CYP1A2CYP1B1

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