SCHEMBL7863389

SCHEMBL7863389

CCC(C)c1cc(Cl)c(C)cc1O.Cc1cc(O)c(C(C)C)c(C)c1Cl

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
RORC P51449 1/20 0.36
TSHR P16473 1/20 0.35
PKM P14618 1/20 0.33
SIRT1 Q96EB6 1/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
BCL2 P10415 1/20 0.31
BCL2L1 Q07817 1/20 0.31
MCL1 Q07820 1/20 0.31
BCL2L2 Q92843 1/20 0.31

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
SCHEMBL28985909 0.89 LMNA (0.54) LMNAALDH1A1GAAMAPTPKM
SCHEMBL574476 0.85 LMNA (0.67) LMNAALDH1A1GAARORCTSHR
SCHEMBL6910713 0.85 LMNA (0.51) LMNAALDH1A1GAAMAPTRORC
SCHEMBL574555 0.81 ALDH1A1 (0.52) LMNAALDH1A1GAAMAPTPKM
SCHEMBL29408625 0.81 ALDH1A1 (0.52) LMNAALDH1A1GAAMAPTPKM
Chlorothymol SCHEMBL6430628 0.76 LMNA (0.68) LMNAALDH1A1GAAMAPTTSHR
SCHEMBL574301 0.73 ALDH1A1 (0.47) LMNAALDH1A1GAAMAPTPKM
SCHEMBL16736811 0.73 LMNA (0.52) LMNAALDH1A1GAARORCTSHR
SCHEMBL15944087 0.73 LMNA (0.52) LMNAALDH1A1GAAMAPTRORC
SCHEMBL16736873 0.72 RORC (0.49) LMNAALDH1A1GAAMAPTRORC

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
WO-2001053443-A1 ANTIMICROBIAL CLEANSING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-07-26 WO disclosed