SCHEMBL7605260

SCHEMBL7605260

CCCc1cccc(O)c1Cl.CCc1cccc(O)c1Cl.Cc1cccc(O)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
IAPP P10997 4/20 0.39
ELANE P08246 1/20 0.38
CTSG P08311 1/20 0.38
BID P55957 3/20 0.37
MCL1 Q07820 3/20 0.37
BCL2L1 Q07817 2/20 0.37
BAK1 Q16611 2/20 0.37
KAT8 Q9H7Z6 2/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
EP300 Q09472 1/20 0.37
KAT2A Q92830 1/20 0.37
KAT2B Q92831 1/20 0.37
KAT5 Q92993 1/20 0.37
SAE1 Q9UBE0 1/20 0.37
TRPA1 O75762 2/20 0.36
TSHR P16473 1/20 0.36
ATM Q13315 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
SCHEMBL6912401 0.92 GABRA1 (0.47) GABRA1GABRB2IAPPELANECTSG
SCHEMBL631373 0.87 TSHR (0.46) GABRA1GABRB2IAPPELANECTSG
SCHEMBL573719 0.83 GABRA1 (0.56) GABRA1GABRB2IAPPTSHRESR1
SCHEMBL16960210 0.81 TAAR1 (0.41) GABRA1GABRB2PPARGPPARATSHR
SCHEMBL15717291 0.79 ESR2 (0.41) ESR1MAPTHSD17B10
2-Chlorophenol SCHEMBL9006411 0.79 ALDH1A1 (0.52) IAPPELANECTSGBIDMCL1
Parachlorophenol SCHEMBL27550492 0.77 ALDH1A1 (0.40) GABRA1GABRB2PPARGPPARATSHR
SCHEMBL3781759 0.77 GABRA1 (0.46) GABRA1GABRB2HTR1ATP53DRD2
SCHEMBL38652649 0.77
SCHEMBL546021 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1176947-A1 ANTIMICROBIAL WIPES THE PROCTER & GAMBLE COMPANY (US) 2002-02-06 EP disclosed
EP-1169017-A1 ANTIMICROBIAL WIPES THE PROCTER & GAMBLE COMPANY (US) 2002-01-09 EP disclosed
WO-2001052811-A1 PERSONAL CLEANSING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-07-26 WO disclosed
WO-2000061107-A1 ANTIMICROBIAL THE PROCTER & GAMBLE COMPANY (US) 2000-10-19 WO disclosed
WO-2000061105-A1 ANTIMICROBIAL WIPES THE PROCTER & GAMBLE COMPANY (US) 2000-10-19 WO disclosed