SCHEMBL26229482

SCHEMBL26229482

CCNC(c1ccc(OC(C)(CC)C(=O)OC(C)(C)C)cc1)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.39
ACACB O00763 2/20 0.35
ADORA3 P0DMS8 1/20 0.35
PPARA Q07869 2/20 0.33
ALDH1A1 P00352 2/20 0.33
PPARG P37231 1/20 0.33
ABCB1 P08183 1/20 0.33
PDE2A O00408 2/20 0.33
CNR1 P21554 3/20 0.32
CNR2 P34972 2/20 0.32
ABCB11 O95342 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
HTR2A P28223 1/20 0.32
PMP22 Q01453 1/20 0.32
ELANE P08246 2/20 0.31

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
SCHEMBL26189986 0.83 OPRK1 (0.48) OPRK1ACACBADORA3PPARAALDH1A1
SCHEMBL10182459 0.81 ALDH1A1 (0.48) OPRK1ACACBADORA3PPARAALDH1A1
SCHEMBL25723402 0.79 OPRK1 (0.40) OPRK1ACACBADORA3PPARAPPARG
SCHEMBL25685772 0.73 OPRK1 (0.39) OPRK1ACACBADORA3PPARAPPARG
SCHEMBL11071169 0.69 OPRK1 (0.76) OPRK1ADORA3PPARAALDH1A1PPARG
SCHEMBL12853898 0.67 OPRK1 (0.50) OPRK1ADORA3ALDH1A1
SCHEMBL20099740 0.66 AAK1 (0.35) OPRK1ALDH1A1CYP3A4TSHR
SCHEMBL5365832 0.66 OPRK1 (0.49) OPRK1ADORA3PPARAALDH1A1PPARG
SCHEMBL13355892 0.66 OPRK1 (0.52) OPRK1ADORA3PPARAALDH1A1PPARG
SCHEMBL3240325 0.66 OPRK1 (0.49) OPRK1ADORA3PPARAALDH1A1PPARG

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
US-20230333478-A1 PATTERN FORMING METHOD, METHOD FOR PRODUCING ELECTRONIC DEVICE, AND KIT FUJIFILM CORPORATION (JP) 2023-10-19 US disclosed
US-11733611-B2 Pattern forming method, method for producing electronic device, and kit FUJIFILM CORPORATION (JP) 2023-08-22 US disclosed