SCHEMBL9570340

SCHEMBL9570340

[O]CCc1nc2cc(C(F)(F)F)ccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.47
NTRK1 P04629 1/20 0.43
NTRK2 Q16620 1/20 0.43
F9 P00740 1/20 0.42
CACNA1H O95180 4/20 0.41
IDO1 P14902 1/20 0.41
TRPV1 Q8NER1 2/20 0.40
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
POLB P06746 1/20 0.39
PIK3CD O00329 1/20 0.39

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
SCHEMBL5681326 0.85 CACNA1H (0.56) PDE10ANTRK1NTRK2F9CACNA1H
SCHEMBL9597974 0.85 PDE10A (0.47) PDE10ANTRK1NTRK2F9CACNA1H
SCHEMBL11973911 0.85 PDE10A (0.47) PDE10ANTRK1NTRK2F9CACNA1H
SCHEMBL5681369 0.82 RAD52 (0.51) PDE10ANTRK1NTRK2F9CACNA1H
SCHEMBL38661777 0.81 CACNA1H (0.62) PDE10ACACNA1HIDO1NPBWR1MAOB
SCHEMBL4556153 0.81 TDP1 (0.47) PDE10ANTRK1NTRK2F9CACNA1H
SCHEMBL367831 0.81 IDO1 (0.45) PDE10ANTRK1NTRK2CACNA1HIDO1
SCHEMBL10284701 0.81 DDAH1 (0.53) PDE10ACACNA1HIDO1NPBWR1KDM4E
SCHEMBL9281215 0.81 RAD52 (0.47) PDE10ANTRK1NTRK2F9CACNA1H
SCHEMBL3372786 0.79 MAOB (0.46) PDE10ANTRK1NTRK2F9CACNA1H

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
US-5270322-A Imidazo[1,2-a]pyridines, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1993-12-14 US disclosed
EP-0555825-A1 Imidazo(1,2-a)pyridines as angiotensin-II-antagonists Dr. Karl Thomae GmbH (DE) 1993-08-18 EP disclosed