SCHEMBL31417619

SCHEMBL31417619

O=C(Nc1ccccc1)Oc1cc(Cl)ccc1F

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 3/20 0.56
▸ ATM Q13315 1/20 0.55
▸ KMT2A Q03164 5/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ MAPT P10636 3/20 0.48
▸ GAA P10253 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ BLM P54132 1/20 0.48
▸ HTT P42858 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ TMPRSS4 Q9NRS4 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ HSP90AA1 P07900 1/20 0.45
▸ GRIK1 P39086 1/20 0.44

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
SCHEMBL31417771 0.90 FAAH (0.55) FAAHATMKMT2AMEN1MAPT
SCHEMBL27663187 0.81 FAAH (0.52) FAAHKMT2AMEN1MAPTGAA
SCHEMBL24168968 0.81 ATM (0.54) ATMKMT2AMEN1MAPTGAA
SCHEMBL31417532 0.79 FAAH (0.56) FAAHMAPTGAAKDM4EHTT
SCHEMBL28181344 0.78 ALDH1A1 (0.55) FAAHKMT2AMEN1MAPTGAA
SCHEMBL26697277 0.76 FAAH (0.56) FAAHKMT2AGAAKDM4EBLM
SCHEMBL8065643 0.76 ALDH1A1 (0.70) ATMKMT2AMEN1MAPTGAA
SCHEMBL28688217 0.75 FAAH (0.62) FAAHATMKMT2AGAAKDM4E
SCHEMBL28913753 0.75 ALDH1A1 (0.59) FAAHKMT2AMEN1MAPTGAA
SCHEMBL28051040 0.73 KMT2A (0.57) ATMKMT2AMEN1MAPTGAA

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-2025016457-A1 NEW SUBSTITUTED HETEROCYCLIC COMPOUND AS GSPTS/MYC SIGNAL FLUX REGULATOR 杭州德睿智药科技有限公司 2025-01-23 — — WO disclosed
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