SCHEMBL13675350

SCHEMBL13675350

CCc1cccc(-c2ccc(S(C)(=O)=O)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.57
PTGS2 P35354 7/20 0.51
PTGDR2 Q9Y5Y4 1/20 0.47
CA12 O43570 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
PTGS1 P23219 1/20 0.45
RORC P51449 3/20 0.44
KIF11 P52732 1/20 0.44
HSD17B1 P14061 1/20 0.43
HSD17B2 P37059 1/20 0.43
FYN P06241 1/20 0.43
GABRA2 P47869 1/20 0.43

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
SCHEMBL3727020 0.85 ADAMTS4 (0.55) PTGS2CA12CA2CA9PTGS1
SCHEMBL2025954 0.85 FYN (0.57) BCL2PTGS2CA12CA2CA9
SCHEMBL24721302 0.85 CA2 (0.68) BCL2PTGS2CA12CA2CA9
SCHEMBL1687505 0.83 NR1H2 (0.52) BCL2PTGDR2RORC
SCHEMBL19496815 0.82 HSD17B1 (0.53) PTGS2RORCHSD17B1HSD17B2
SCHEMBL24721144 0.82 PTGS2 (0.55) BCL2PTGS2CA12CA2CA9
SCHEMBL13634219 0.81 UCHL1 (0.59) PTGS2PTGDR2CA2PTGS1
SCHEMBL24721535 0.81 BCL2 (0.51) BCL2PTGS2CA12CA2CA9
SCHEMBL8233359 0.80 ALDH1A1 (0.47) PTGDR2
SCHEMBL8770634 0.80 PTGS2 (0.68) PTGS2CA12CA2CA9PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090270381-A1 Non-steroidal progesterone receptor modulators BAYER SCHERING PHARMA AG (DE) 2009-10-29 US disclosed
WO-2009077186-A1 NONSTEROIDAL PROGESTERONE RECEPTOR MODULATORS BAYER SCHERING PHARMA AKTIENGESLLSCHAFT (DE) 2009-06-25 WO disclosed
EP-2070909-A1 Non-steroidal progesterone receptor modulators Bayer Schering Pharma AG (DE) 2009-06-17 EP disclosed
US-20090075989-A1 NON-STEROIDAL PROGESTERONE RECEPTOR MODULATORS BAYER SCHERING PHARMA AG (DE) 2009-03-19 US disclosed
US-20070179189-A1 Modulators of the glucocorticoid receptor, AP-1, and/or NF-kB activity and use thereof BRISTOL-MYERS SQUIBB COMPANY 2007-08-02 US 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 (3 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-20090270381-A1 Non-steroidal progesterone receptor modulators PGR, PGRMC1, PGRMC2 BCL2 2800/4885PTGS2 48/4885PTGDR2 31/4885
US-20090075989-A1 NON-STEROIDAL PROGESTERONE RECEPTOR MODULATORS NR5A1, CYP19A1, GPER1 BCL2 3423/4885PTGS2 72/4885PTGDR2 36/4885
US-20070179189-A1 Modulators of the glucocorticoid receptor, AP-1, and/or NF-kB activity and use thereof NFRKB, NFKBIA, NFKB2 BCL2 2206/4885PTGS2 735/4885PTGDR2 1373/4885

“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.