SCHEMBL9258559

SCHEMBL9258559

COC1CCOC(c2cccc(COc3ccc4c(-c5ccsc5)cc(=O)oc4c3)c2)C1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.48
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
AR P10275 1/20 0.42
MAOA P21397 2/20 0.41
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 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
SCHEMBL9263552 0.92 MAOB (0.47) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL9268130 0.92 MAOB (0.46) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL9269565 0.91 MAOB (0.49) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL9254545 0.90 MAOB (0.61) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL9267747 0.88 MAOB (0.48) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL9259277 0.85 RAB9A (0.61) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL9258376 0.85 ALOX5 (0.45) MAOBARMAOA
SCHEMBL9259265 0.85 ALOX5 (0.37) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL9270438 0.85 MAOB (0.41) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL9157666 0.84 ALOX5 (0.39) MAOBNPC1RAB9A

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-5424320-A Antihistamine, antiallergic, antiinflammatory and cytoprotective agents MERCK FROSST CANADA, INC. (CA) 1995-06-13 US disclosed