SCHEMBL9635899

SCHEMBL9635899

O=C(O)COc1cccc(-c2nc3cnccc3[nH]2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
MAPT P10636 4/20 0.53
KDM4E B2RXH2 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
POLB P06746 3/20 0.53
ALDH1A1 P00352 3/20 0.53
LMNA P02545 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
FABP4 P15090 1/20 0.52
HDAC6 Q9UBN7 11/20 0.50
HDAC3 O15379 10/20 0.50
HDAC4 P56524 10/20 0.50
HDAC1 Q13547 10/20 0.50
HDAC7 Q8WUI4 10/20 0.50
HDAC2 Q92769 10/20 0.50
HDAC10 Q969S8 10/20 0.50
HDAC11 Q96DB2 10/20 0.50
HDAC8 Q9BY41 10/20 0.50
HDAC9 Q9UKV0 10/20 0.50

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
SCHEMBL9635829 0.88 HDAC6 (0.50) MEN1KMT2AMAPTKDM4ESMN1; SMN2
SCHEMBL9634891 0.86 PDE3B (0.48) MEN1KMT2AMAPTKDM4ESMN1; SMN2
SCHEMBL9636119 0.86 MEN1 (0.56) MEN1KMT2AHDAC6HDAC3HDAC4
SCHEMBL9634295 0.85 HDAC6 (0.53) MEN1KMT2AMAPTKDM4ESMN1; SMN2
SCHEMBL9635672 0.83 MAPT (0.56) MAPTKDM4ESMN1; SMN2ALDH1A1LMNA
SCHEMBL9634572 0.82 ADORA2A (0.48) MEN1KMT2AMAPTLMNAL3MBTL1
SCHEMBL9634499 0.81 HDAC6 (0.49) MEN1KMT2AMAPTKDM4ESMN1; SMN2
SCHEMBL9634529 0.81 PDE3B (0.43) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL9634643 0.81 MAOB (0.49) MAPTKDM4ESMN1; SMN2ALDH1A1HDAC6
SCHEMBL9636045 0.81 HDAC6 (0.43) MEN1KMT2AMAPTKDM4ESMN1; SMN2

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
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-A1 2-Arylimidazopyridines MERCK PATENT GmbH (DE) 1983-03-02 EP disclosed