SCHEMBL31233897

SCHEMBL31233897

Fc1ccc2ncccc2c1N=C=S

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.47
▸ MAPT P10636 2/20 0.47
▸ CYP3A4 P08684 1/20 0.40
▸ LMNA P02545 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ BLM P54132 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ HSP90AB1 P08238 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ APLNR P35414 1/20 0.37
▸ MPI P34949 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ ERN1 O75460 2/20 0.36
▸ POLB P06746 1/20 0.35
▸ IDE P14735 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ CYP11B2 P19099 2/20 0.34
▸ NCOA1 Q15788 2/20 0.33

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
SCHEMBL26124342 1.00 KDM4E (0.47) KDM4EMAPTCYP3A4LMNAMEN1
SCHEMBL26121106 0.81 MAPT (0.47) KDM4EMAPTCYP3A4LMNAMEN1
SCHEMBL31233902 0.81 MAPT (0.47) KDM4EMAPTCYP3A4LMNAMEN1
SCHEMBL9654404 0.72 MAPT (0.58) KDM4EMAPTCYP3A4LMNAMEN1
SCHEMBL4726688 0.71 ALDH1A1 (0.55) KDM4EMAPTCYP3A4LMNAMEN1
SCHEMBL30387307 0.71 KDM4E (0.62) KDM4EMAPTCYP3A4LMNAMEN1
SCHEMBL4054902 0.71 KDM4E (0.62) KDM4EMAPTCYP3A4LMNAMEN1
SCHEMBL8692398 0.69 NPC1 (0.41) KDM4EMAPTHSP90AA1APLNRL3MBTL1
SCHEMBL383262 0.68 GABRA1 (0.48) CYP3A4ALDH1A1
SCHEMBL384468 0.68 APLNR (0.43) KDM4ELMNAAPLNRMPIL3MBTL1

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-118946553-A SARM1 inhibitor compound, pharmaceutical composition comprising the same, and preparation method and use thereof 深圳众格生物科技有限公司 2024-11-12 — — CN disclosed
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