SCHEMBL7997689

SCHEMBL7997689

CC(N)Cn1ccc2ccc(Cl)cc21

nearest known ligand 0.77

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 17/20 0.77
HTR2A P28223 15/20 0.77
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2C9 P11712 1/20 0.62
HTR2B P41595 1/20 0.62
KMO O15229 1/20 0.50
PRMT5 O14744 1/20 0.47
HTR7 P34969 1/20 0.47

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
Fumaric Acid SCHEMBL7997829 0.88 HTR2C (0.61) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
Fumaric Acid SCHEMBL7997834 0.88 HTR2C (0.61) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL8959591 0.87 HTR2C (1.00) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL7092716 0.87 HTR2C (1.00) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL9232780 0.87 HTR2C (1.00) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL24144837 0.87 HTR2C (0.58) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL7676168 0.84 HTR2C (0.55) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL7676174 0.84 HTR2C (0.55) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL9230485 0.82 HTR2C (1.00) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL9230483 0.82 HTR2C (1.00) HTR2CHTR2ACYP1A2CYP3A4CYP2C9

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
WO-2001040183-A1 1-AMINOALKYL-1H-INDOLES FOR TREATING GLAUCOMA ALCON UNIVERSAL LTD. (CH) 2001-06-07 WO claimed