SCHEMBL31470190

SCHEMBL31470190

[C-]#[N+]c1ccc(C(=O)OCC(=O)NC2CCCCCC2)cc1

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.70
MEN1 O00255 5/20 0.67
ATM Q13315 1/20 0.67
POLB P06746 1/20 0.67
L3MBTL1 Q9Y468 2/20 0.59
TDP1 Q9NUW8 1/20 0.57
ALDH1A1 P00352 1/20 0.55
RAB9A P51151 1/20 0.55

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
SCHEMBL31470176 1.00 KMT2A (0.70) KMT2AMEN1ATMPOLBL3MBTL1
SCHEMBL31470160 0.99 KMT2A (0.71) KMT2AMEN1ATMPOLBL3MBTL1
SCHEMBL11285606 0.84 KMT2A (0.97) KMT2AMEN1ATMPOLBL3MBTL1
SCHEMBL31470197 0.79 MEN1 (0.58) KMT2AMEN1ATMPOLBL3MBTL1
SCHEMBL31470144 0.78 CXCR4 (0.47) KMT2AALDH1A1RAB9A
SCHEMBL31470199 0.76 POLB (0.66) KMT2AMEN1POLBL3MBTL1TDP1
SCHEMBL31470201 0.76 GAA (0.63) KMT2AMEN1POLBTDP1ALDH1A1
SCHEMBL31470166 0.73 TSHR (0.69) KMT2AMEN1POLBL3MBTL1ALDH1A1
SCHEMBL31470169 0.72 ALDH1A1 (0.56) KMT2AMEN1POLBTDP1ALDH1A1
SCHEMBL31470192 0.72 KDM4E (0.55) KMT2AMEN1ALDH1A1RAB9A

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
WO-2025027448-A1 ANTIBACTERIAL AGENTS, COMPOSITIONS AND USES THEREOF Università Degli Studi del Piemonte Orientale “Amedeo Avogadro” (IT) 2025-02-06 WO claimed
WO-2025027448-A1 ANTIBACTERIAL AGENTS, COMPOSITIONS AND USES THEREOF Università Degli Studi del Piemonte Orientale “Amedeo Avogadro” (IT) 2025-02-06 WO disclosed