SCHEMBL8764040

SCHEMBL8764040

CC(C)OOP(=O)(COS(=O)(=O)c1c(Cl)cccc1C(C)C)OOC(C)C

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.30
ITGB1 P05556 1/20 0.30
ITGA4 P13612 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
SCHEMBL8764717 0.95 KMT2A (0.30)
SCHEMBL8764685 0.93
SCHEMBL8764595 0.91 KMT2A (0.32) NR1H4
SCHEMBL8764462 0.89
SCHEMBL8734635 0.88 TSHR (0.34) ITGB1ITGA4
SCHEMBL8764537 0.87
SCHEMBL8763777 0.87
SCHEMBL8764522 0.86 KMT2A (0.32)
SCHEMBL8763949 0.86 NR3C1 (0.34)
SCHEMBL8764545 0.84

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
EP-0511826-B1 Phosphosulfonate herbicides ROHM & HAAS (US) 1997-07-16 EP claimed