SCHEMBL31504359

SCHEMBL31504359

O=C(NCCCC1CCCCC1)c1ccccc1Nc1ccc(OCc2ccccc2)cc1C1CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SGMS2 Q8NHU3 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ MAOB P27338 2/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAOA P21397 1/20 0.42
▸ CTSV O60911 1/20 0.41
▸ CTSL P07711 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ SIRT2 Q8IXJ6 3/20 0.40
▸ CHRM4 P08173 2/20 0.40
▸ HDAC3 O15379 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ CNR2 P34972 2/20 0.39

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
SCHEMBL21617297 1.00 SGMS2 (0.43) SGMS2LMNAMAPTPKMMAOB
SCHEMBL31504451 0.95 MAOB (0.46) SGMS2MAOBKMT2ASMN1; SMN2MEN1
SCHEMBL21617306 0.95 MAOB (0.46) SGMS2MAOBKMT2ASMN1; SMN2MEN1
SCHEMBL21623472 0.89 NPC1 (0.45) SGMS2LMNAMAOBKMT2ASMN1; SMN2
SCHEMBL31504318 0.89 NPC1 (0.45) SGMS2LMNAMAOBKMT2ASMN1; SMN2
SCHEMBL23308005 0.88 ALDH1A1 (0.45) SGMS2MAOBKMT2ASMN1; SMN2MEN1
SCHEMBL21617188 0.84 MAOB (0.47) SGMS2MAOBKMT2ASMN1; SMN2MEN1
SCHEMBL31504389 0.84 MAOB (0.47) SGMS2MAOBKMT2ASMN1; SMN2MEN1
SCHEMBL21617165 0.82 MAOB (0.46) SGMS2MAOBKMT2ASMN1; SMN2MEN1
SCHEMBL31504355 0.82 MAOB (0.46) SGMS2MAOBKMT2ASMN1; SMN2MEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3820850-B1 PHENYL/PYRIDYL-N-PHENYL/PYRIDYL DERIVATIVES FOR TREATING A RNA VIRUS INFECTION ABIVAX (FR) 2026-04-01 — — EP disclosed
CN-112638877-B Phenyl/pyridinyl-N-phenyl/pyridinyl derivatives for the treatment of RNA viral infections ABIVAX公司 2025-04-22 — — CN disclosed
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