SCHEMBL8855833

SCHEMBL8855833

C=CCc1c(OCc2ccccc2)cc2c(c1O)OC(CO)C2

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 3/20 0.34
ERN1 O75460 1/20 0.32
PDE4B Q07343 1/20 0.32
PTPN1 P18031 1/20 0.32

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
SCHEMBL8855656 0.74 CYP1A2 (0.42)
SCHEMBL6628867 0.74 DRD2 (0.34)
SCHEMBL6628639 0.74 DRD2 (0.34)
SCHEMBL4238441 0.71 CYP2C19 (0.42) SIRT1ERN1PTPN1
SCHEMBL28416923 0.66 RAB9A (0.39) SIRT1
SCHEMBL31644480 0.66 LMNA (0.42)
SCHEMBL7561778 0.65 CYP2C19 (0.41) PTPN1
SCHEMBL10689679 0.65 HTR1A (0.48) PTPN1
SCHEMBL9194110 0.65 MAPT (0.42) ERN1PTPN1
SCHEMBL9028070 0.65 NPC1 (0.38)

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
JP-9208573-A None JP disclosed
JP-H09208573-A BENZOFURAN DERIVATIVE AND ITS USE MEIJI MILK PROD CO LTD 1997-08-12 JP disclosed