SCHEMBL9700149

SCHEMBL9700149

CCCCCCCCOc1cc(OCCCCCCCC)c(OCCCCCCCC)c(C(=O)O)c1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 2/20 0.59
PTPN11 Q06124 8/20 0.54
TP53 P04637 1/20 0.51
TSHR P16473 1/20 0.51
S1PR3 Q99500 1/20 0.51
PLA2G4B P0C869 1/20 0.50
BLM P54132 1/20 0.49
PTPN1 P18031 1/20 0.48
PTPN6 P29350 1/20 0.48
RARB P10826 1/20 0.48

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
SCHEMBL5095051 0.85 PLA2G2A (0.59) PLA2G2APTPN11TP53TSHRS1PR3
SCHEMBL9304719 0.85 PLA2G2A (0.59) PLA2G2APTPN11TP53TSHRS1PR3
SCHEMBL5090283 0.85 PLA2G2A (0.59) PLA2G2APTPN11TP53TSHRS1PR3
SCHEMBL11049569 0.85 PLA2G2A (0.59) PLA2G2APTPN11TP53TSHRS1PR3
SCHEMBL23748612 0.84 PLA2G2A (0.56) PLA2G2APTPN11TP53TSHRS1PR3
SCHEMBL23352171 0.84 PLA2G2A (0.56) PLA2G2APTPN11TP53TSHRS1PR3
SCHEMBL5492191 0.82 PTPN11 (0.64) PLA2G2APTPN11TP53TSHRS1PR3
SCHEMBL7820620 0.82 PTPN11 (0.64) PLA2G2APTPN11TP53TSHRS1PR3
SCHEMBL25788077 0.81 PTPN11 (0.67) PTPN11TP53TSHRS1PR3PLA2G4B
SCHEMBL9417624 0.81 PTPN11 (0.67) PTPN11TP53TSHRS1PR3PLA2G4B

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-0507576-A1 Polypropylene-based resin compositions TOSOH CORPORATION (JP) 1992-10-07 EP disclosed