SCHEMBL8959941

SCHEMBL8959941

Cc1cccc2c1ccn2C[C@H](C)N

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 17/20 1.00
HTR2A P28223 14/20 1.00
PRMT5 O14744 1/20 0.49
P2RX7 Q99572 1/20 0.43

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
SCHEMBL9234276 1.00 HTR2C (1.00) HTR2CHTR2APRMT5P2RX7
SCHEMBL8959931 1.00 HTR2C (1.00) HTR2CHTR2APRMT5P2RX7
Fumaric Acid SCHEMBL8959716 0.88 HTR2C (0.77) HTR2CHTR2APRMT5P2RX7
Fumaric Acid SCHEMBL8959706 0.88 HTR2C (0.77) HTR2CHTR2APRMT5P2RX7
SCHEMBL8959689 0.83 HTR2C (0.71) HTR2CHTR2APRMT5P2RX7
SCHEMBL8959700 0.83 HTR2C (0.71) HTR2CHTR2APRMT5P2RX7
SCHEMBL27343269 0.78 HTR2C (0.64) HTR2CHTR2APRMT5
SCHEMBL2120779 0.77 HTR2C (0.62) HTR2CHTR2APRMT5P2RX7
SCHEMBL14527150 0.74 HTR2C (0.61) HTR2CHTR2A
SCHEMBL24656041 0.74 HTR2C (0.58) HTR2CHTR2APRMT5P2RX7

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-5494928-A FOR CENTRAL NERVOUS SYSTEM DISORDERS, BLOCKING SEROTONIN RECEPTORS, ANTIDEPRESSANTS HOFFMANN-LA ROCHE INC. (US) 1996-02-27 US disclosed