SCHEMBL10799600

SCHEMBL10799600

CCn1nc(-c2ccc(F)cc2)c2c1CCN(CCCC(=O)c1ccc(F)cc1)C2

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 1/20 0.53
▸ DRD2 P14416 1/20 0.53
▸ HTR2A P28223 1/20 0.53
▸ HTR7 P34969 1/20 0.53
▸ HRH1 P35367 1/20 0.53
▸ DRD3 P35462 1/20 0.53
▸ HTR2B P41595 1/20 0.53

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
SCHEMBL10805648 0.89 KCNK3 (0.60) HTR1ADRD2HTR2AHTR7HRH1
SCHEMBL10805409 0.89 HTR1A (0.54) HTR1ADRD2HTR2AHTR7HRH1
SCHEMBL10799991 0.87 KCNK3 (0.68) HTR1ADRD2HTR2AHTR7HRH1
SCHEMBL10801105 0.86 HTR1A (0.49) HTR1ADRD2HTR2AHTR7HRH1
Hydrochloric Acid SCHEMBL10814988 0.86 KCNK3 (0.67) HTR1ADRD2HTR2AHTR7HRH1
SCHEMBL10803941 0.85 DRD2 (0.56) HTR1ADRD2HTR2AHTR7HRH1
SCHEMBL10818999 0.81 HTR5A (0.56) —
SCHEMBL10805163 0.77 — —
SCHEMBL10805772 0.75 KCNK3 (0.53) HTR1ADRD2HTR2AHTR7HRH1
SCHEMBL10805968 0.75 KCNK3 (0.59) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0086422-B1 PHARMACOLOGICALLY ACTIVE PYRAZOLO(4,3-C)PYRIDINES GRUPPO LEPETIT S.p.A. (IT) 1987-09-30 — — EP disclosed
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