SCHEMBL8912557

SCHEMBL8912557

C=CC(Cl)(Cl)CCCCC

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
ALDH1A1 P00352 2/20 0.36
FDPS P14324 11/20 0.35
SMPD1 P17405 2/20 0.34
THRB P10828 1/20 0.33
GGPS1 O95749 7/20 0.32

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
SCHEMBL28381123 0.95 TSHR (0.41) TSHRALDH1A1FDPSSMPD1THRB
SCHEMBL4350913 0.81
SCHEMBL380942 0.80 TSHR (0.39) TSHRALDH1A1FDPSSMPD1THRB
SCHEMBL17005798 0.76 TSHR (0.41) TSHRALDH1A1FDPSSMPD1THRB
SCHEMBL5176511 0.76 FDPS (0.42) TSHRALDH1A1FDPSSMPD1THRB
SCHEMBL31201072 0.76 TSHR (0.43) TSHRALDH1A1FDPSSMPD1THRB
SCHEMBL3550686 0.75 FDPS (0.35) TSHRALDH1A1FDPSSMPD1THRB
SCHEMBL14909789 0.75 FDPS (0.40) TSHRFDPSSMPD1GGPS1
SCHEMBL18240327 0.74 TSHR (0.42) TSHRALDH1A1FDPSSMPD1THRB
SCHEMBL17479115 0.74 TSHR (0.48) TSHRALDH1A1FDPSSMPD1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0763070-A1 FUEL CELL INCORPORATING NOVEL ION-CONDUCTING MEMBRANE DAIS CORPORATION (US) 1997-03-19 EP disclosed
WO-1995032236-A1 FUEL CELL INCORPORATING NOVEL ION-CONDUCTING MEMBRANE DAIS CORPORATION (US) 1995-11-30 WO disclosed