SCHEMBL11565475

SCHEMBL11565475

Cc1c(Cl)c(Cl)c(Cl)c(Cc2c(Cl)c(Cl)c(Cl)c(Cl)c2Cl)c1Cl

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
SIRT1 Q96EB6 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
SCHEMBL11523542 0.97 TP53 (0.34) TP53CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL11524830 0.80 TSHR (0.35) CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL8846796 0.80
SCHEMBL11764869 0.78
SCHEMBL1004507 0.77 MEN1 (0.33)
SCHEMBL5484139 0.74
SCHEMBL13173786 0.74
SCHEMBL631112 0.73 MEN1 (0.31)
SCHEMBL8679447 0.73
SCHEMBL12889649 0.73 NOS3 (0.30)

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-4141912-A Process for the preparation of polyhalobenzylic disulfooxonium compounds HOOKER CHEMICALS & PLASTICS CORP. (US) 1979-02-27 US disclosed
US-4075238-A Polyhalobenzylic disulfooxonium compounds HOOKER CHEMICALS & PLASTICS CORPORATION (US) 1978-02-21 US disclosed