SCHEMBL4313898

SCHEMBL4313898

CS(=O)(=O)c1cc[c]c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.31
KEAP1 Q14145 1/20 0.31
CYP1A2 P05177 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
SCHEMBL2534154 0.87 CA2 (0.32) BCAT2KEAP1
SCHEMBL11548155 0.81 CA2 (0.50)
SCHEMBL7764280 0.81 ELANE (0.36)
SCHEMBL1804225 0.81 TTR (0.43) CYP1A2
SCHEMBL18207235 0.80 PTGS1 (0.37)
SCHEMBL8651626 0.80
SCHEMBL7475023 0.78 HTR6 (0.45)
SCHEMBL17288500 0.77 MEN1 (0.30)
SCHEMBL26092150 0.73 MCL1 (0.48) KEAP1
SCHEMBL250357 0.73 KEAP1 (0.54) KEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090318720-A1 Process for selectively synthesising 3 alpha-hydroxychlormadinone acetate GRUNENTHAL GMBH (DE) 2009-12-24 US disclosed
WO-2009141110-A1 METHOD FOR THE SELECTIVE SYNTHESIS OF 3-ALPHA-HYDROXY-CHLORMADINONE ACETATE Grünenthal GmbH (DE) 2009-11-26 WO disclosed
EP-0866367-A2 Radiation sensitive composition JSR Corporation (JP) 1998-09-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090318720-A1 Process for selectively synthesising 3 alpha-hydroxychlormadinone acetate CYP51A1, HSD17B7, HSD17B13 BCAT2 697/4885KEAP1 518/4885CYP1A2 52/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.