SCHEMBL10786276

SCHEMBL10786276

Cc1cccc(C[CH][NH])c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.52
IDO1 P14902 2/20 0.50
ACHE P22303 2/20 0.48
HRH3 Q9Y5N1 1/20 0.43
MAOB P27338 4/20 0.42
MAOA P21397 1/20 0.41
CTBP2 P56545 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
GPR84 Q9NQS5 1/20 0.40
TP53 P04637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL5793223 0.82 TAAR1 (0.52) TAAR1IDO1ACHEHRH3MAOB
SCHEMBL10783126 0.82 IDO1 (0.55) TAAR1IDO1ACHEHRH3MAOB
SCHEMBL1124900 0.82 TAAR1 (0.52) TAAR1IDO1ACHEHRH3MAOB
SCHEMBL28879868 0.80 TAAR1 (0.50) TAAR1IDO1ACHEHRH3MAOB
SCHEMBL3102135 0.80 TAAR1 (0.50) TAAR1IDO1ACHEHRH3MAOB
SCHEMBL3116562 0.80 TAAR1 (0.50) TAAR1IDO1ACHEHRH3MAOB
SCHEMBL3109159 0.80 TAAR1 (0.50) TAAR1IDO1ACHEHRH3MAOB
SCHEMBL2137377 0.80 TAAR1 (0.50) TAAR1IDO1ACHEHRH3MAOB
SCHEMBL31481296 0.80 TAAR1 (0.50) TAAR1IDO1ACHEHRH3MAOB
SCHEMBL27392270 0.80 TAAR1 (0.55) TAAR1IDO1ACHEHRH3MAOB

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-0154095-B1 PROCESS FOR STABILIZING METHYLENEIMINE COMPOUND AND STABILIZED METHYLENEIMINE COMPOSITION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1987-08-05 EP claimed