SCHEMBL31355923

SCHEMBL31355923

O=C1CCN(c2ccc(NC(=O)c3ccc(CN4CCCCC4)cc3)cc2)C(=O)N1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNF P01375 1/20 0.59
▸ ALDH1A1 P00352 3/20 0.53
▸ CYP2C9 P11712 3/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ CYP1A2 P05177 2/20 0.53
▸ CYP2D6 P10635 2/20 0.53
▸ ALOX15 P16050 2/20 0.53
▸ HPGD P15428 1/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ LMNA P02545 2/20 0.53
▸ HTT P42858 2/20 0.53
▸ GAA P10253 1/20 0.53
▸ DDB1 Q16531 1/20 0.51
▸ CRBN Q96SW2 1/20 0.51
▸ NPC1 O15118 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL31356107 0.89 RAB9A (0.49) TNFALDH1A1KDM4ERAB9AKMT2A
SCHEMBL31356263 0.88 RAB9A (0.52) TNFALDH1A1CYP2C9KDM4EHPGD
SCHEMBL31356153 0.84 TRPV1 (0.49) TNFALDH1A1ALOX15HPGDRAB9A
SCHEMBL31356137 0.82 DDB1 (0.52) ALDH1A1KDM4EGAADDB1CRBN
SCHEMBL31356173 0.79 TNF (0.58) TNFALDH1A1CYP2C9KDM4ECYP1A2
SCHEMBL31355945 0.79 DDB1 (0.62) TNFALDH1A1CYP2C9KDM4ECYP1A2
SCHEMBL28663251 0.79 RAB9A (0.76) TNFALDH1A1CYP2C9KDM4ECYP1A2
SCHEMBL22079996 0.79 RAB9A (0.76) TNFALDH1A1CYP2C9KDM4ECYP1A2
SCHEMBL31355887 0.78 HDAC6 (0.54) CYP2C9KDM4EKMT2ADDB1CRBN
SCHEMBL13683732 0.78 TNF (0.75) TNFALDH1A1CYP2C9KDM4ECYP1A2

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-2025026422-A1 ARYL OR HETEROARYL SUBSTITUTED GLUTARIMIDE DERIVATIVE AND USE THEREOF 标新生物医药科技(上海)有限公司 2025-02-06 — — WO claimed
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