SCHEMBL7769340

SCHEMBL7769340

COc1cc(CCc2ccc(-c3ccccc3)cc2)ccc1O

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.64
TAAR1 Q96RJ0 2/20 0.63
TSHR P16473 2/20 0.63
MAPK1 P28482 1/20 0.63
LMNA P02545 1/20 0.61
GLA P06280 1/20 0.61
ALOX5 P09917 2/20 0.59
NOS2 P35228 1/20 0.57
GAA P10253 3/20 0.56
ATM Q13315 1/20 0.56
ALDH1A1 P00352 1/20 0.55
NFKB1 P19838 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
AKR1B1 P15121 1/20 0.55
OR51E2 Q9H255 1/20 0.55
POLB P06746 1/20 0.54
SLC2A1 P11166 1/20 0.53

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
SCHEMBL16355871 0.92 PTPN1 (0.70) PTPN1TAAR1TSHRMAPK1LMNA
SCHEMBL23754156 0.92 PTPN1 (0.70) PTPN1TAAR1TSHRMAPK1LMNA
SCHEMBL7715224 0.89 PTPN1 (0.71) PTPN1TAAR1TSHRMAPK1LMNA
SCHEMBL29740697 0.88 PTPN1 (0.79) PTPN1TAAR1TSHRMAPK1LMNA
SCHEMBL29604390 0.86 PTPN1 (0.82) PTPN1TAAR1TSHRMAPK1LMNA
SCHEMBL17780116 0.86 PTPN1 (0.82) PTPN1TAAR1TSHRMAPK1LMNA
SCHEMBL7717965 0.86 PTPN1 (0.62) PTPN1TAAR1TSHRMAPK1LMNA
SCHEMBL7709744 0.84 PTPN1 (0.60) PTPN1TAAR1TSHRMAPK1LMNA
SCHEMBL27779114 0.84 ALOX5 (0.75) PTPN1TAAR1TSHRMAPK1LMNA
SCHEMBL29105738 0.84 ALOX5 (0.75) PTPN1TAAR1TSHRMAPK1LMNA

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-2001098245-A2 TRIPHENYL COMPOUNDS AS INTERLEUKIN-4 ANTAGONISTS SUNESIS PHARMACEUTICALS, INC. (US) 2001-12-27 WO disclosed