SCHEMBL31464123

SCHEMBL31464123

OB(O)Oc1cc(OCc2ccccc2)ccc1F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.49
▸ LMNA P02545 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ PTGS1 P23219 1/20 0.47
▸ SLC6A2 P23975 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ PTGS2 P35354 1/20 0.47
▸ SLC6A3 Q01959 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ HDAC6 Q9UBN7 1/20 0.47
▸ MAOB P27338 8/20 0.45
▸ CYP4F2 P78329 1/20 0.44
▸ CYP4A11 Q02928 1/20 0.44
▸ NR4A2 P43354 2/20 0.43
▸ CTSV O60911 1/20 0.43
▸ CTSL P07711 1/20 0.43
▸ NR4A1 P22736 1/20 0.43
▸ NR4A3 Q92570 1/20 0.43
▸ LIPE Q05469 1/20 0.43
▸ GAA P10253 1/20 0.42

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
SCHEMBL31166954 0.84 ALOX5 (0.58) ALOX5LMNACYP1A2PTGS1SLC6A2
SCHEMBL15365 0.80 MAOB (0.58) ALOX5LMNACYP1A2PTGS1SLC6A2
SCHEMBL4770223 0.79 LIPE (0.46) ALOX5LMNACYP1A2PTGS1SLC6A2
SCHEMBL23210154 0.79 LIPE (0.53) ALOX5LMNACYP1A2PTGS1SLC6A2
SCHEMBL15817 0.77 ALOX5 (0.61) ALOX5LMNACYP1A2PTGS1SLC6A2
SCHEMBL1373373 0.77 LMNA (0.66) ALOX5LMNACYP1A2PTGS1SLC6A2
SCHEMBL1942638 0.76 MAOB (0.62) ALOX5MAOBCYP4F2CYP4A11NR4A2
SCHEMBL31464147 0.76 MEN1 (0.51) ALOX5LMNACYP1A2PTGS1SLC6A2
SCHEMBL4770265 0.76 THRA (0.44) ALOX5LMNACYP1A2PTGS1SLC6A2
SCHEMBL1711426 0.76 LIPE (0.53) ALOX5LMNACYP1A2PTGS1SLC6A2

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-119816484-A Novel piperazine derivative or salt thereof and pharmaceutical composition 富士胶片株式会社 2025-04-11 — — CN disclosed
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