SCHEMBL9501799

SCHEMBL9501799

OCc1ncccc1SCCCCCCCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GPR84 Q9NQS5 2/20 0.41
PLA2G7 Q13093 7/20 0.41
KDM6B O15054 1/20 0.41
KDM4A O75164 1/20 0.41
KDM4D Q6B0I6 1/20 0.41
KDM3B Q7LBC6 1/20 0.41
HIF1AN Q9NWT6 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
DAGLA Q9Y4D2 2/20 0.40
PLA2G4B P0C869 1/20 0.39
PLA2G4A P47712 1/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HPGD P15428 1/20 0.38

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
SCHEMBL9501780 0.77 PLA2G7 (0.44) NPC1RAB9ASMN1; SMN2GPR84PLA2G7
SCHEMBL3600150 0.74 CYP11B1 (0.46) KDM4EALDH1A1L3MBTL1
SCHEMBL5102757 0.67 ALDH1A1 (0.50) KDM4EALDH1A1L3MBTL1
SCHEMBL31299270 0.67 ALDH1A1 (0.53) KDM4ENPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL24023978 0.67 MAPT (0.50)
SCHEMBL8332511 0.66 HPGD (0.53) HPGD
SCHEMBL6238584 0.66 ALDH1A1 (0.44) KDM4EALDH1A1L3MBTL1HPGD
SCHEMBL10696175 0.66 KDM4E (0.49) KDM4ENPC1RAB9ASMN1; SMN2DAGLA
SCHEMBL26705850 0.66 ALDH1A1 (0.59) KDM4ENPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL3598246 0.66 HCAR2 (0.45) KDM4EDAGLAPLA2G4BHPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0548291-A1 PYRIDYLTHIO OR PYRIDYLOXY ALKANOIC ACIDS SMITHKLINE BEECHAM CORPORATION (US) 1993-06-30 EP disclosed
WO-1992005156-A1 PYRIDYLTHIO OR PYRIDYLOXY ALKANOIC ACIDS SMITHKLINE BEECHAM CORPORATION (US) 1992-04-02 WO disclosed