SCHEMBL31417546

SCHEMBL31417546

O=C(CC1CNC1)Nc1ccc(Cl)cc1F

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.55
▸ NPC1 O15118 4/20 0.54
▸ ALDH1A1 P00352 5/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ MAPT P10636 3/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ RAB9A P51151 3/20 0.45
▸ CHRM1 P11229 1/20 0.45
▸ PKM P14618 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ HPGD P15428 2/20 0.44

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
SCHEMBL26090731 0.79 ALDH1A1 (0.36) KMT2ANPC1ALDH1A1L3MBTL1MAPT
SCHEMBL17737049 0.78 IDO1 (0.67) KMT2ANPC1ALDH1A1L3MBTL1MAPT
SCHEMBL20838661 0.78 IDO1 (0.67) KMT2ANPC1ALDH1A1L3MBTL1MAPT
SCHEMBL17737354 0.78 IDO1 (0.67) KMT2ANPC1ALDH1A1L3MBTL1MAPT
SCHEMBL20852681 0.78 IDO1 (0.67) KMT2ANPC1ALDH1A1L3MBTL1MAPT
SCHEMBL29103863 0.76 NPC1 (0.61) KMT2ANPC1ALDH1A1L3MBTL1MAPT
SCHEMBL24499421 0.75 NPC1 (0.59) KMT2ANPC1ALDH1A1L3MBTL1MAPT
SCHEMBL19464682 0.75 ALDH1A1 (0.60) KMT2ANPC1ALDH1A1L3MBTL1MAPT
SCHEMBL31417758 0.74 USP30 (0.61) KMT2ANPC1ALDH1A1L3MBTL1MAPT
SCHEMBL26090529 0.74 KDR (0.43) ALDH1A1

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-2025016457-A1 NEW SUBSTITUTED HETEROCYCLIC COMPOUND AS GSPTS/MYC SIGNAL FLUX REGULATOR 杭州德睿智药科技有限公司 2025-01-23 — — WO disclosed
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