SCHEMBL31469522

SCHEMBL31469522

O=CCC(c1ccccc1)n1ncc(-c2ccccc2)n1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.32
▸ CYP19A1 P11511 2/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ OPRK1 P41145 2/20 0.32
▸ DAGLA Q9Y4D2 1/20 0.31
▸ MAPT P10636 2/20 0.31
▸ POLB P06746 1/20 0.31
▸ PHGDH O43175 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL31469548 0.76 MAOA (0.35) KMT2ACYP19A1MEN1SMN1; SMN2NPC1
SCHEMBL31469558 0.76 RAB9A (0.39) KMT2ACYP19A1MEN1SMN1; SMN2NPC1
SCHEMBL31469546 0.75 HPGD (0.47) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL31469551 0.75 HPGD (0.41) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL31469517 0.74 DAGLA (0.39) DAGLAMAPTPOLB
SCHEMBL31469505 0.72 MAPT (0.45) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL31469550 0.72 HPGD (0.41) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL31469509 0.72 DAGLA (0.40) DAGLAMAPTPOLBHPGDMAPK1
SCHEMBL31469542 0.72 HPGD (0.44) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL14270969 0.70 KMT2A (0.42) KMT2AMEN1SMN1; SMN2NPC1RAB9A

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-119490463-A Beta-triazole derivative and synthetic method and application thereof 华东师范大学 2025-02-21 — — CN disclosed
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