SCHEMBL8713244

SCHEMBL8713244

CCC(Cc1ccc(OC)c(OC)c1)(C[C@H](N)O)c1cccc(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
HTT P42858 2/20 0.38
LMNA P02545 1/20 0.38
RECQL P46063 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
STAT3 P40763 1/20 0.36
SCN5A Q14524 3/20 0.36
SCN9A Q15858 3/20 0.36
CTSD P07339 1/20 0.36
KIF11 P52732 1/20 0.36
CYP19A1 P11511 1/20 0.36
PDE4D Q08499 1/20 0.36
REN P00797 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL8714131 0.88 HTT (0.45) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL8713256 0.87 SMN1; SMN2 (0.45) HTTLMNANPSR1MAPTSMN1; SMN2
SCHEMBL8714039 0.86 LMNA (0.39) MEN1KMT2AHTTLMNARECQL
SCHEMBL8433303 0.84 MEN1 (0.39) MEN1KMT2AHTTLMNARECQL
SCHEMBL8433905 0.84 MEN1 (0.39) MEN1KMT2AHTTLMNARECQL
SCHEMBL8714164 0.83 KIF11 (0.38) SCN5ASCN9AKIF11
SCHEMBL8715439 0.80 HTT (0.44) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL8713922 0.74 LMNA (0.49) MEN1KMT2AHTTLMNARECQL
SCHEMBL8713860 0.73 HTT (0.47) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL8716946 0.72 ADRB2 (0.41) HTTLMNASMN1; SMN2STAT3CYP19A1

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