SCHEMBL9039249

SCHEMBL9039249

CCCCCCCCCCCCOc1ccc([N+](=O)[O-])cc1C(C)=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.56
CYSLTR1 Q9Y271 1/20 0.56
CYP19A1 P11511 4/20 0.55
S1PR3 Q99500 1/20 0.50
RAB9A P51151 1/20 0.50
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48
PTPN11 Q06124 3/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
NR1I2 O75469 1/20 0.47
CHRM2 P08172 1/20 0.47
CYP3A4 P08684 1/20 0.47
ADRA2A P08913 1/20 0.47
OPRK1 P41145 1/20 0.47
HTR2B P41595 1/20 0.47
SLC6A3 Q01959 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47

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
SCHEMBL28745869 0.90 S1PR3 (0.63) CYSLTR2CYSLTR1CYP19A1S1PR3THRA
SCHEMBL27545224 0.88 CYSLTR2 (0.55) CYSLTR2CYSLTR1CYP19A1S1PR3RAB9A
SCHEMBL27518496 0.88 MAPT (0.59) CYSLTR2CYSLTR1CYP19A1S1PR3RAB9A
SCHEMBL7970263 0.88 S1PR3 (0.61) CYSLTR2CYSLTR1CYP19A1S1PR3PTPN11
SCHEMBL27571908 0.87 CYP19A1 (0.56) CYSLTR2CYSLTR1CYP19A1S1PR3RAB9A
SCHEMBL16430716 0.87 MAPT (0.57) CYSLTR2CYSLTR1CYP19A1S1PR3RAB9A
SCHEMBL7970564 0.86 CYP19A1 (0.54) CYSLTR2CYSLTR1CYP19A1S1PR3RAB9A
SCHEMBL5016734 0.85 CYP3A4 (0.54) RAB9ALMNAMAPTKMT2AMEN1
SCHEMBL9127581 0.83 CYP19A1 (0.66) CYSLTR2CYSLTR1CYP19A1RAB9ATHRA
SCHEMBL9165752 0.83 CYP19A1 (0.66) CYSLTR2CYSLTR1CYP19A1RAB9ATHRA

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-0367498-B1 Photographic material and process comprising a pyrazoloazole dyeforming coupler EASTMAN KODAK CO (US) 1996-06-19 EP disclosed
EP-0367498-A2 Photographic material and process comprising a pyrazoloazole dyeforming coupler EASTMAN KODAK COMPANY (US) 1990-05-09 EP disclosed