SCHEMBL10029772

SCHEMBL10029772

OOCCc1ccc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 8/20 0.41
CA2 P00918 8/20 0.41
TAAR1 Q96RJ0 1/20 0.34
PTPN2 P17706 2/20 0.33
PTPN1 P18031 2/20 0.33
PTPN6 P29350 2/20 0.33
STS P08842 1/20 0.33
PTPN11 Q06124 1/20 0.33
MAOB P27338 1/20 0.31
IDO1 P14902 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
SCHEMBL29120822 0.81 CA2 (0.42) CA1CA2TAAR1PTPN2PTPN1
SCHEMBL21066253 0.79 CA2 (0.43) CA1CA2TAAR1PTPN2PTPN1
SCHEMBL13410386 0.77 KIF11 (0.36) CA1CA2TAAR1PTPN2PTPN1
SCHEMBL3954026 0.77 KIF11 (0.36) CA1CA2TAAR1PTPN2PTPN1
SCHEMBL673282 0.75 LMNA (0.43) CA1CA2
SCHEMBL18242489 0.75 TAAR1 (0.38) CA1CA2TAAR1PTPN2PTPN1
SCHEMBL18378596 0.75 TAAR1 (0.38) CA1CA2TAAR1PTPN2PTPN1
SCHEMBL5490791 0.73 TAAR1 (0.34) CA1CA2TAAR1PTPN2PTPN1
SCHEMBL5486697 0.73 TAAR1 (0.34) CA1CA2TAAR1PTPN2PTPN1
SCHEMBL2183842 0.73 MAOB (0.42) CA1CA2TAAR1MAOBIDO1

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
WO-2012027593-A1 ELECTRON-DEFICIENT FLUOROUS PORPHYRINS AND METHODS OF MAKING AND THEIR USE IN ORGANIC SOLAR CELLS THE UNIVERSITY OF SOUTH DAKOTA (US) 2012-03-01 WO disclosed