SCHEMBL8960083

SCHEMBL8960083

Fc1ccc(C2=CCCNC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.61
ADRA2B P18089 1/20 0.61
HTR2A P28223 6/20 0.49
HTR6 P50406 2/20 0.43
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
CHRM2 P08172 2/20 0.38
CHRM3 P20309 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
SCHEMBL1239862 0.84 HTR2C (0.44) ADRA2AADRA2BHTR2AHTR6HTR2C
Hydrochloric Acid SCHEMBL2828350 0.82 HTR2C (0.46) ADRA2AADRA2BHTR2AHTR6HTR2C
SCHEMBL29140051 0.80 ADRA2A (0.61) ADRA2AADRA2BHTR2AHTR6HTR2C
SCHEMBL8960144 0.80 ADRA2A (0.61) ADRA2AADRA2BHTR2AHTR2CHTR2B
SCHEMBL8960049 0.80 ADRA2A (0.61) ADRA2AADRA2BHTR2AHTR2CHTR2B
SCHEMBL3689759 0.79 HTR2C (0.42) ADRA2AADRA2BHTR2AHTR6HTR2C
SCHEMBL4789087 0.79 ADRA2A (0.59) ADRA2AADRA2BHTR2AHTR6HTR2C
SCHEMBL9311684 0.78 ADRA2A (0.54) ADRA2AADRA2BHTR2AHTR6HTR2C
Hydrochloric Acid SCHEMBL3547223 0.78 HTR2C (0.44) ADRA2AADRA2BHTR2AHTR6HTR2C
Hydrochloric Acid SCHEMBL9252509 0.78 ADRA2A (0.58) ADRA2AADRA2BHTR2AHTR6HTR2C

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
EP-0691956-A1 3-PHENYL-1,2,5,6-TETRAHYDROPYRIDINE DERIVATIVES AS SEDATIVES LABORATOIRE L. LAFON (FR) 1996-01-17 EP disclosed
WO-1994022827-A1 3-PHENYL-1,2,5,6-TETRAHYDROPYRIDINE DERIVATIVES AS SEDATIVES LABORATOIRE L. LAFON (FR) 1994-10-13 WO disclosed