SCHEMBL8714039

SCHEMBL8714039

CCC(Cc1ccc(OC)c(OC)c1)(C[C@H](N)O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
CDK8 P49336 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
HTT P42858 1/20 0.38
RECQL P46063 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GAA P10253 2/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
STAT3 P40763 1/20 0.37
CYP19A1 P11511 1/20 0.36
CA2 P00918 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
LDHA P00338 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
SCHEMBL8713244 0.86 MEN1 (0.38) LMNAMEN1KMT2AMAPTHTT
SCHEMBL8718432 0.84 LMNA (0.40) LMNAMEN1KMT2AMAPTMAPK1
SCHEMBL8714131 0.84 HTT (0.45) LMNAMEN1KMT2AHTTSTAT3
SCHEMBL8713256 0.81 SMN1; SMN2 (0.45) LMNAMAPTHTTNPSR1KDM4E
SCHEMBL8715439 0.76 HTT (0.44) LMNAMEN1KMT2AHTTSTAT3
SCHEMBL8713922 0.74 LMNA (0.49) LMNAMEN1KMT2AHTTRECQL
SCHEMBL8714103 0.71 EPHX2 (0.41) LMNASTAT3CYP19A1CA2KDM4E
SCHEMBL8717242 0.71 ESR1 (0.46) LMNANPSR1STAT3CYP19A1CA2
SCHEMBL8719246 0.70 ATM (0.40) KMT2AMAPK1HTTSTAT3CYP19A1
SCHEMBL8712989 0.70 MMP1 (0.43) LMNAKMT2ASTAT3CYP19A1CA2

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-5811293-A CULTURE PRODUCT AS CHEMICAL INTERMEDIATE FOR ANTI-OBESITY AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-22 US disclosed