SCHEMBL8908120

SCHEMBL8908120

O=C(Oc1ccc(-c2ccc(O)cc2)cc1)c1ccc(OC2CCCCO2)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
PTPN1 P18031 1/20 0.41
SENP1 Q9P0U3 1/20 0.40
TNK2 Q07912 2/20 0.37
F2 P00734 1/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
ELANE P08246 1/20 0.36
LMNA P02545 2/20 0.35
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL217929 0.87 TNK2 (0.43) KMT2AMEN1PTPN1TNK2
SCHEMBL16073032 0.85 ACR (0.48) KMT2AMEN1PRSS1LMNAKDM4E
SCHEMBL8908122 0.84 MEN1 (0.53) KMT2AMEN1PTPN1
SCHEMBL222127 0.83 MEN1 (0.67) KMT2AMEN1PRSS1LMNASMN1; SMN2
SCHEMBL15093765 0.83 MEN1 (0.43) KMT2AMEN1PTPN1TNK2
SCHEMBL15093959 0.83 MEN1 (0.43) KMT2AMEN1PTPN1TNK2
SCHEMBL222919 0.83 MEN1 (0.43) KMT2AMEN1PTPN1TNK2
SCHEMBL1531846 0.82 MEN1 (0.61) KMT2AMEN1TNK2LMNASMN1; SMN2
SCHEMBL27006326 0.81 KMT2A (0.54) KMT2AMEN1PTPN1
SCHEMBL9330107 0.80 KMT2A (0.57) KMT2AMEN1PRSS1LMNASMN1; SMN2

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-5637254-A ACRYLATED ESTERS HOECHST AKTIENGESELLSCHAFT (DE) 1997-06-10 US disclosed