SCHEMBL28097374

SCHEMBL28097374

B.NCc1ccc(F)cc1

nearest known ligand 0.94

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 4/20 0.94
MAOB P27338 4/20 0.61
TAAR1 Q96RJ0 3/20 0.59
HRH3 Q9Y5N1 1/20 0.55
IDO1 P14902 3/20 0.50
AGXT P21549 2/20 0.50
ABAT P80404 1/20 0.50

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
SCHEMBL21063 0.97
Ammonia Solution, Strong SCHEMBL4750128 0.94 LOXL2 (0.94) LOXL2MAOBTAAR1HRH3IDO1
Hydrochloric Acid SCHEMBL3847812 0.94 LOXL2 (0.94) LOXL2MAOBTAAR1HRH3IDO1
Iodide SCHEMBL20838270 0.94 LOXL2 (0.94) LOXL2MAOBTAAR1HRH3IDO1
Bromide SCHEMBL31513710 0.94 LOXL2 (0.94) LOXL2MAOBTAAR1HRH3IDO1
Hydrochloric Acid SCHEMBL3830237 0.94 LOXL2 (0.94) LOXL2MAOBTAAR1HRH3IDO1
Hydrochloric Acid SCHEMBL6153650 0.92 LOXL2 (0.89) LOXL2MAOBTAAR1HRH3IDO1
Ethylamine SCHEMBL1568352 0.89 LOXL2 (0.84) LOXL2MAOBTAAR1HRH3IDO1
SCHEMBL4415525 0.89 LOXL2 (0.84) LOXL2MAOBTAAR1HRH3IDO1
SCHEMBL14829415 0.89 LOXL2 (0.84) LOXL2MAOBTAAR1HRH3IDO1

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
CN-104073018-B A series of 2,3,5,6-tetra-thiophene with longwave absorption characteristic replaces BODIPY dyestuff and preparation method 天津大学 2016-09-28 CN disclosed