SCHEMBL9309726

SCHEMBL9309726

C=Cc1ccc(Oc2ccccc2)c(CC)c1CC

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
DPP4 P27487 1/20 0.39
LTA4H P09960 3/20 0.38
SLC6A4 P31645 2/20 0.37
RIPK1 Q13546 1/20 0.37
SLC6A2 P23975 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
TTR P02766 3/20 0.36
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
HTR2A P28223 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
SCHEMBL9310140 0.87 LMNA (0.47) LMNAGAAKMT2ADPP4LTA4H
SCHEMBL9311738 0.79 ALDH1A1 (0.38) LMNAGAAKMT2AALDH1A1HPGD
SCHEMBL2168215 0.77
SCHEMBL9310348 0.76 KMT2A (0.42) LMNAGAAKMT2ALTA4HSLC6A4
SCHEMBL895837 0.74 TTR (0.41) LMNAGAAKMT2ALTA4HALDH1A1
SCHEMBL25714252 0.74 DPP4 (0.53) LMNAGAAKMT2ADPP4LTA4H
Diphenylether SCHEMBL29291793 0.72 LTA4H (0.44) LMNAGAAKMT2ALTA4HSLC6A4
SCHEMBL298766 0.72 LMNA (0.64) LMNAGAAKMT2ALTA4HALDH1A1
SCHEMBL30618855 0.72 LMNA (0.64) LMNAGAAKMT2ALTA4HALDH1A1
SCHEMBL31443510 0.71 LMNA (0.49) LMNAGAAKMT2ADPP4SLC6A4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5326489-A Sulfonated polymer NIPPON SHOKUBAI CO., LTD. (JP) 1994-07-05 US disclosed
EP-0523300-B1 Electrorheological fluids NIPPON CATALYTIC CHEM IND (JP) 1994-01-19 EP disclosed
EP-0523300-A1 Electrorheological fluids NIPPON SHOKUBAI KAGAKU KOGYO CO. LTD. (JP) 1993-01-20 EP disclosed