SCHEMBL31417771

SCHEMBL31417771

O=C(Nc1ccccc1)Oc1ccc(Cl)cc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 3/20 0.55
▸ ATM Q13315 1/20 0.54
▸ KMT2A Q03164 3/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ PPARG P37231 3/20 0.51
▸ PPARA Q07869 3/20 0.51
▸ MAPT P10636 2/20 0.50
▸ KDM4E B2RXH2 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ LMNA P02545 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ GPR27 Q9NS67 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ TMPRSS4 Q9NRS4 1/20 0.46
▸ CYP11B1 P15538 1/20 0.45
▸ CYP11B2 P19099 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 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
SCHEMBL31417619 0.90 FAAH (0.56) FAAHATMKMT2AMEN1MAPT
SCHEMBL26697277 0.84 FAAH (0.56) FAAHKMT2AKDM4EGAABLM
SCHEMBL24168968 0.82 ATM (0.54) ATMKMT2AMEN1PPARAMAPT
SCHEMBL28181344 0.77 ALDH1A1 (0.55) FAAHKMT2AMEN1MAPTKDM4E
SCHEMBL22372581 0.77 PPARG (0.51) ATMPPARGPPARALMNACYP11B1
SCHEMBL9730220 0.76 PPARG (0.57) KMT2APPARGPPARACYP11B1CYP11B2
SCHEMBL3666560 0.75 SMN1; SMN2 (0.49) FAAHKMT2AMEN1PPARGPPARA
SCHEMBL26697229 0.75 KMT2A (0.54) ATMKMT2AMEN1MAPTKDM4E
SCHEMBL8065643 0.74 ALDH1A1 (0.70) ATMKMT2AMEN1MAPTKDM4E
SCHEMBL22372576 0.74 L3MBTL1 (0.54) KMT2AMEN1PPARGPPARAMAPT

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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