SCHEMBL8913702

SCHEMBL8913702

Oc1cc(Cl)cc(O)c1Oc1ccc(Cl)cc1Cl

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 5/20 0.72
HPGD P15428 2/20 0.72
NR1I2 O75469 1/20 0.72
LMNA P02545 1/20 0.72
PGR P06401 1/20 0.72
HSP90AA1 P07900 1/20 0.72
ADORA3 P0DMS8 1/20 0.72
MAPT P10636 1/20 0.72
HSPA5 P11021 1/20 0.72
CBR1 P16152 1/20 0.72
TBXA2R P21731 1/20 0.72
SLC6A2 P23975 1/20 0.72
AGTR1 P30556 1/20 0.72
SLC6A3 Q01959 1/20 0.72
TSHR P16473 3/20 0.48
HSD17B10 Q99714 3/20 0.48
ALDH1A1 P00352 2/20 0.48
CYP3A4 P08684 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
STK39 Q9UEW8 1/20 0.46

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
Triclosan SCHEMBL29356111 0.84 TTR (1.00) TTRHPGDNR1I2LMNAPGR
Triclosan SCHEMBL3269 0.84 TTR (1.00) TTRHPGDNR1I2LMNAPGR
Triclosan SCHEMBL29367506 0.84 TTR (1.00) TTRHPGDNR1I2LMNAPGR
Triclosan SCHEMBL526378 0.84 TTR (1.00) TTRHPGDNR1I2LMNAPGR
Triclosan SCHEMBL29354475 0.84 TTR (1.00) TTRHPGDNR1I2LMNAPGR
SCHEMBL29436001 0.84 TTR (0.59) TTRHPGDNR1I2LMNAPGR
SCHEMBL3805624 0.83 TTR (0.55) TTRHPGDNR1I2LMNAPGR
Triclosan SCHEMBL8975439 0.82 TTR (0.96) TTRHPGDNR1I2LMNAPGR
Triclosan SCHEMBL8055151 0.82 TTR (0.96) TTRHPGDNR1I2LMNAPGR
Triclosan SCHEMBL8015104 0.82 TTR (0.96) TTRHPGDNR1I2LMNAPGR

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-5597019-A Dilution system for filling spray bottles ECOLAB INC. (US) 1997-01-28 US disclosed