SCHEMBL13612539

SCHEMBL13612539

CCCCCCOCCOCCOC(=O)CCCCC(=O)Oc1ccc(C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DGKA P23743 1/20 0.54
▸ KMT2A Q03164 4/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ PLA2G4B P0C869 2/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ CNR2 P34972 1/20 0.44
▸ ESR1 P03372 1/20 0.44
▸ DNM1 Q05193 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ SLC22A2 O15244 1/20 0.43
▸ TMPRSS2 O15393 1/20 0.43
▸ F2 P00734 1/20 0.43
▸ F10 P00742 1/20 0.43
▸ PLG P00747 1/20 0.43
▸ F12 P00748 1/20 0.43
▸ PLAU P00749 1/20 0.43
▸ PLAT P00750 1/20 0.43
▸ KLKB1 P03952 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43

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
SCHEMBL14163924 1.00 DGKA (0.54) DGKAKMT2ASMN1; SMN2PLA2G4BNPC1
SCHEMBL13854873 0.97 DGKA (0.50) DGKAKMT2ASMN1; SMN2PLA2G4BNPC1
SCHEMBL13854770 0.92 DGKA (0.57) DGKAKMT2ASMN1; SMN2PLA2G4BCNR2
SCHEMBL13612543 0.88 HTR2C (0.51) DGKAKMT2ASMN1; SMN2PLA2G4BNPC1
SCHEMBL13612550 0.88 HTR2C (0.51) DGKAKMT2ASMN1; SMN2PLA2G4BNPC1
SCHEMBL12589643 0.86 DGKA (0.50) DGKAKMT2ASMN1; SMN2PLA2G4BNPC1
SCHEMBL13763454 0.86 KMT2A (0.61) DGKAKMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL3505506 0.86 KMT2A (0.61) DGKAKMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL3504944 0.86 KMT2A (0.61) DGKAKMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL13763455 0.86 KMT2A (0.61) DGKAKMT2ASMN1; SMN2NPC1RAB9A

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
US-7622432-B2 Lubricant composition and triazine-ring-containing compound FUJIFILM CORPORATION (JP) 2009-11-24 — — US disclosed
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