SCHEMBL29135427

SCHEMBL29135427

COc1ccc(CNC(=O)NCCCCCOC(N)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 1/20 0.53
▸ NPC1 O15118 4/20 0.49
▸ RAB9A P51151 4/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ POLB P06746 2/20 0.47
▸ CHRM2 P08172 1/20 0.47
▸ PPIB P23284 1/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ HTT P42858 1/20 0.45

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
SCHEMBL24011409 0.83 CASR (0.59) CASRNPC1RAB9ASMN1; SMN2POLB
SCHEMBL26764081 0.83 CNR1 (0.60) CASRNPC1RAB9ASMN1; SMN2
SCHEMBL26633938 0.83 CASR (0.62) CASRNPC1RAB9ASMN1; SMN2POLB
SCHEMBL24011467 0.82 CASR (0.62) CASRNPC1RAB9AMEN1KMT2A
SCHEMBL24011468 0.82 CASR (0.62) CASRNPC1RAB9AMEN1KMT2A
SCHEMBL30288106 0.81 CASR (0.52) CASRNPC1RAB9ASMN1; SMN2POLB
SCHEMBL24576223 0.79 NPC1 (0.71) CASRNPC1RAB9ASMN1; SMN2POLB
SCHEMBL13366908 0.78 CASR (0.63) CASRNPC1RAB9ASMN1; SMN2POLB
SCHEMBL24011214 0.78 CASR (0.53) CASRNPC1RAB9ASMN1; SMN2POLB
SCHEMBL12508207 0.76 CASR (0.63) CASRNPC1RAB9ASMN1; SMN2POLB

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-115843295-A NAMPT modulators 赛特凯恩蒂克公司 2023-03-24 — — CN disclosed
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