SCHEMBL8715437

SCHEMBL8715437

CCCC(Cc1ccc(OC)c(OC)c1)C(N)C(O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 10/20 0.51
LDHA P00338 1/20 0.46
ADRB2 P07550 1/20 0.46
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
STAT3 P40763 1/20 0.42
KDM4E B2RXH2 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
AOC3 Q16853 1/20 0.41

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
SCHEMBL8715434 1.00 SIGMAR1 (0.51) SIGMAR1LDHAADRB2ALDH1A1LMNA
SCHEMBL8714129 0.90 LDHA (0.48) SIGMAR1LDHAADRB2ALDH1A1LMNA
SCHEMBL8714130 0.90 LDHA (0.48) SIGMAR1LDHAADRB2ALDH1A1LMNA
SCHEMBL8713854 0.83 ALOX15 (0.53) SIGMAR1LDHAADRB2ALDH1A1LMNA
SCHEMBL8713857 0.83 ALOX15 (0.53) SIGMAR1LDHAADRB2ALDH1A1LMNA
SCHEMBL8713241 0.78 PPARG (0.43) LDHAADRB2
SCHEMBL8713237 0.78 PPARG (0.43) LDHAADRB2
SCHEMBL10028825 0.76 ADRB2 (0.66) LDHAADRB2ALDH1A1LMNASTAT3
SCHEMBL8713254 0.76 SMN1; SMN2 (0.47) LDHAALDH1A1LMNAKDM4E
SCHEMBL8713251 0.76 SMN1; SMN2 (0.47) LDHAALDH1A1LMNAKDM4E

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