SCHEMBL8908645

SCHEMBL8908645

CCCC[Si](Cl)(CCCC)CCCCl

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.53
TDP1 Q9NUW8 2/20 0.53
ALDH1A1 P00352 2/20 0.48
FAAH O00519 2/20 0.33
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.30

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
SCHEMBL8907033 0.90 TSHR (0.57) TSHRTDP1ALDH1A1FAAHLMNA
SCHEMBL348204 0.88 TSHR (0.40) TSHRTDP1ALDH1A1LMNATHRB
Ammonia Solution, Strong SCHEMBL27832272 0.85 TSHR (0.38) TSHRTDP1ALDH1A1LMNATHRB
SCHEMBL706714 0.85 TSHR (0.38) TSHRTDP1ALDH1A1LMNATHRB
SCHEMBL704794 0.85 TSHR (0.38) TSHRTDP1ALDH1A1LMNATHRB
SCHEMBL703090 0.85 TSHR (0.38) TSHRTDP1ALDH1A1LMNATHRB
SCHEMBL17966484 0.85 TSHR (0.43) TSHRTDP1ALDH1A1
SCHEMBL3482229 0.82 TSHR (0.35) TSHRTDP1ALDH1A1LMNATHRB
SCHEMBL2273982 0.82 TSHR (0.35) TSHRTDP1ALDH1A1LMNATHRB
SCHEMBL8908335 0.81 TSHR (0.50) TSHRTDP1ALDH1A1FAAHLMNA

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
US-5624680-A SKIN ABSORPTION OF DRUGS WITH POLYETHERSILOXANE BLOCK COPOLYMERS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1997-04-29 US disclosed
EP-0710688-A1 HYDROXYSILYL-TERMINATED POLYOXYETHYLENE COMPOUND, QUATERNARY-SALT-TERMINATED BLOCK COPOLYMER, AND PERCUTANEOUS ABSORPTION PROMOTER SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-05-08 EP disclosed