SCHEMBL9804573

SCHEMBL9804573

Oc1c(Cc2ccccc2)cc(C2CCCCC2)cc1Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.46
BCL2L1 Q07817 1/20 0.46
PTPN1 P18031 3/20 0.43
PTPN2 P17706 1/20 0.43
PTPN6 P29350 1/20 0.43
ALOX5 P09917 1/20 0.41
KMO O15229 1/20 0.41
ACMSD Q8TDX5 1/20 0.40

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
SCHEMBL9804552 0.98 BCL2 (0.47) BCL2BCL2L1PTPN1PTPN2PTPN6
SCHEMBL9249706 0.87 PTPN1 (0.59) BCL2BCL2L1PTPN1PTPN2PTPN6
SCHEMBL4054377 0.87 ESR2 (0.44) ACMSD
SCHEMBL22103998 0.84 MEN1 (0.51) BCL2BCL2L1ALOX5KMOACMSD
SCHEMBL22103975 0.84 MEN1 (0.51) BCL2BCL2L1ALOX5KMOACMSD
SCHEMBL9445279 0.83 CNR2 (0.39) KMOACMSD
SCHEMBL12161247 0.81 NUDT1 (0.41) KMOACMSD
SCHEMBL8155478 0.80 HSPA5 (0.40)
SCHEMBL8153644 0.80 AMY1A (0.42)
SCHEMBL18544650 0.79 CYP2C9 (0.43) KMOACMSD

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
EP-0186255-B1 PROCESS FOR PREPARING BENZYL SUBSTITUTED PHENOLS, DIBENZYLPHENOLIC COMPOUNDS, AND THE ANTIOXIDANT USE OF SUCH PHENOLS ETHYL CORPORATION (US) 1991-04-10 EP disclosed
EP-0186255-A2 Process for preparing benzyl substituted phenols, dibenzylphenolic compounds, and the antioxidant use of such phenols ETHYL CORPORATION (US) 1986-07-02 EP disclosed