SCHEMBL23655331

SCHEMBL23655331

Cc1ccc(N2CCN(c3ccc(CNC=O)cc3)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
GAA P10253 2/20 0.53
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
LMNA P02545 1/20 0.53
ALOX15 P16050 1/20 0.53
ALOX12 P18054 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
ADH1B P00325 1/20 0.46
ADH1C P00326 1/20 0.46
ADH1A P07327 1/20 0.46
ADH7 P40394 1/20 0.46
MEN1 O00255 3/20 0.45

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
SCHEMBL23655611 0.95 NCF1 (0.51) MAPTGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL23655578 0.86 CA2 (0.43) MAPTGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL23655548 0.86 GAA (0.44) MAPTGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL23655342 0.85 ADH1B (0.61) MAPTGAAALDH1A1LMNAALOX15
SCHEMBL31566 0.84 ADH1B (0.61) MAPTGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL23655583 0.84 ADH1B (0.46) MAPTGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL23655787 0.84 L3MBTL1 (0.53) MAPTGAAALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL3305094 0.83 ALDH1A1 (0.53) MAPTGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL23655375 0.83 RAB9A (0.56) MAPTGAASMN1; SMN2LMNANPC1
SCHEMBL3304463 0.82 L3MBTL1 (0.54) MAPTGAAKDM4EALDH1A1SMN1; SMN2

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
EP-3027615-B1 ANTI-INFECTIVE COMPOUNDS PASTEUR INSTITUT KOREA (KR) 2021-07-21 EP disclosed