SCHEMBL8364658

SCHEMBL8364658

O=CCC1Cc2ccccc2C1=O

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 4/20 0.61
CYP19A1 P11511 1/20 0.54
ACHE P22303 7/20 0.53
HTR1A P08908 1/20 0.51
DRD2 P14416 1/20 0.51
HTR2A P28223 1/20 0.51
HTR2C P28335 1/20 0.51
HTR7 P34969 1/20 0.51
HRH1 P35367 1/20 0.51
DRD3 P35462 1/20 0.51
HTR2B P41595 1/20 0.51
SIGMAR1 Q99720 1/20 0.46

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
SCHEMBL874650 0.84 METAP1 (0.57) METAP1CYP19A1ACHEHTR1ADRD2
SCHEMBL9431516 0.83 CYP19A1 (0.56) METAP1CYP19A1ACHEHTR1ADRD2
SCHEMBL8873256 0.81 METAP1 (0.58) METAP1CYP19A1ACHEHTR1ADRD2
SCHEMBL8873261 0.81 METAP1 (0.58) METAP1CYP19A1ACHEHTR1ADRD2
SCHEMBL8873267 0.81 METAP1 (0.58) METAP1CYP19A1ACHEHTR1ADRD2
SCHEMBL8875391 0.80 ACHE (0.53) METAP1CYP19A1ACHEHTR1AHTR2C
SCHEMBL8594813 0.80 TYRO3 (0.43) METAP1CYP19A1ACHEHTR1ADRD2
SCHEMBL8873394 0.80 TYRO3 (0.43) METAP1CYP19A1ACHEHTR1ADRD2
SCHEMBL28949987 0.79 METAP1 (0.51) METAP1CYP19A1ACHEHTR1ADRD2
SCHEMBL15617634 0.78 METAP1 (0.62) METAP1CYP19A1ACHEHTR1ADRD2

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
US-6699909-B1 MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS; CENTRAL NERVOUS SYSTEM DISORDERS PRESCIENT NEUROPHARMA INC. (CA) 2004-03-02 US disclosed