SCHEMBL9820143

SCHEMBL9820143

CCCCCc1ccc(OC(CCCCC)C([NH])=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 6/20 0.56
PPARG P37231 5/20 0.51
THRB P10828 2/20 0.51
THRA P10827 1/20 0.51
ALDH1A1 P00352 1/20 0.46
S1PR1 P21453 5/20 0.45
S1PR2 O95136 3/20 0.45
CTRC Q99895 1/20 0.45
PTGES O14684 1/20 0.44
ALOX5 P09917 1/20 0.44
S1PR3 Q99500 2/20 0.44
PTPN1 P18031 1/20 0.43
S1PR4 O95977 2/20 0.43
S1PR5 Q9H228 2/20 0.43
RARB P10826 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
SCHEMBL27689995 0.86 PPARA (0.70) PPARAPPARGTHRBTHRAALDH1A1
SCHEMBL15199289 0.86 PPARA (0.70) PPARAPPARGTHRBTHRAALDH1A1
SCHEMBL5696326 0.86 PPARA (0.70) PPARAPPARGTHRBTHRAALDH1A1
SCHEMBL9796813 0.86 PPARA (0.56) PPARAPPARGTHRBTHRAALDH1A1
SCHEMBL27689973 0.83 PPARA (0.57) PPARAPPARGTHRBTHRAALDH1A1
SCHEMBL7784485 0.82 CTRC (0.52) PPARAPPARGALDH1A1CTRCPTGES
SCHEMBL28472645 0.82 PPARA (0.65) PPARAPPARGTHRBTHRAS1PR1
SCHEMBL27629942 0.82 PPARA (0.58) PPARAPPARGTHRBTHRAALDH1A1
SCHEMBL10377004 0.82 CTRC (0.44) PPARAPPARGTHRBTHRACTRC
SCHEMBL10378987 0.82 TP53 (0.56) CTRCRARB

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
EP-0234783-B1 LIGHT-SENSITIVE SILVER HALIDE PHOTOGRAPHIC MATERIAL KONICA CORPORATION (JP) 1991-12-27 EP disclosed