SCHEMBL15097478

SCHEMBL15097478

COSc1ccc(C(C)C)c(C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.39
AR P10275 9/20 0.39
S1PR1 P21453 1/20 0.38
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
RORC P51449 1/20 0.33
P2RX7 Q99572 1/20 0.33
TRPA1 O75762 1/20 0.30

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
SCHEMBL20388930 0.79 AR (0.41) NOTUMARS1PR1PDE3BPDE3A
SCHEMBL15097613 0.79 AR (0.36) AR
SCHEMBL15097610 0.77 PDE2A (0.33)
SCHEMBL20388971 0.77 NOTUM (0.39) NOTUMARS1PR1PDE3BPDE3A
SCHEMBL15097477 0.76 AR (0.38) NOTUMAR
SCHEMBL15097617 0.74 GABRA1 (0.31)
SCHEMBL13784396 0.74 AR (0.43) NOTUMARS1PR1PDE3BPDE3A
SCHEMBL10624896 0.71 NOTUM (0.44) NOTUMARS1PR1PDE3BPDE3A
SCHEMBL8291096 0.71 PDE2A (0.50) NOTUMARS1PR1PDE3BPDE3A
SCHEMBL4547922 0.71 NOTUM (0.44) NOTUMARS1PR1PDE3BPDE3A

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-20130177851-A1 PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-11 US disclosed