SCHEMBL97588

SCHEMBL97588

CCn1c(=O)c2ccccc2c2cc(C#N)ccc21

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.54
PGR P06401 5/20 0.54
RORC P51449 13/20 0.52
RORA P35398 4/20 0.49
RORB Q92753 4/20 0.49
DPP4 P27487 2/20 0.47
NPC1 O15118 1/20 0.46

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
SCHEMBL96088 0.86 CFTR (0.50) PGRRORCRORARORB
SCHEMBL29643208 0.85 PTGER4 (0.63) PTGER4RORC
SCHEMBL5892136 0.85 PTGER4 (0.63) PTGER4RORC
SCHEMBL21076080 0.83 RORC (0.52) PTGER4RORC
SCHEMBL96715 0.82 CFTR (0.49) PGRRORCRORARORBDPP4
SCHEMBL11720741 0.78 PGR (0.69) PGRRORCRORARORBNPC1
SCHEMBL20227728 0.78 PGR (0.58) PGRRORCRORARORBNPC1
SCHEMBL16119985 0.77 ALDH1A1 (0.56) PTGER4RORCNPC1
SCHEMBL21599453 0.76 PTGER4 (0.47) PTGER4RORC
SCHEMBL28267835 0.76 HPGD (0.52) PTGER4RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362252-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-29 US disclosed
EP-1797082-B1 CARBOSTYRIL COMPOUND OTSUKA PHARMA CO LTD (JP) 2012-08-29 EP disclosed
EP-2426128-A1 Carbostyril compound Otsuka Pharmaceutical Co., Limited (JP) 2012-03-07 EP disclosed
CN-101068810-B Carbostyril compound OTSUKA PHARMA CO LTD 2011-02-09 CN disclosed
US-20100261705-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2010-10-14 US disclosed
US-7777038-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-08-17 US disclosed
CN-101068810-A Carbostyril compound OTSUKA PHARMA CO LTD (JP) 2007-11-07 CN disclosed
US-20070179173-A1 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 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 (2 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-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 PTGER4 368/4885PGR 3206/4885RORC 1844/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 PTGER4 368/4885PGR 3206/4885RORC 1844/4885

“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.