SCHEMBL97327

SCHEMBL97327

COc1ccc(CC2SC(=O)NC2=O)c2c1N(Cc1ccc(C(=O)Nc3ccc(C(C)C)cc3)cc1)C(=O)CC2

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.38
▸ TP53 P04637 1/20 0.37
▸ MAPT P10636 3/20 0.37
▸ PTPN1 P18031 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ CPT1A P50416 3/20 0.35
▸ CPT1B Q92523 3/20 0.35
▸ CPT2 P23786 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ POLB P06746 2/20 0.34
▸ CXCR3 P49682 1/20 0.34
▸ EGFR P00533 1/20 0.34
▸ ERBB2 P04626 1/20 0.34
▸ NPC1 O15118 1/20 0.34

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
SCHEMBL98176 0.89 ABCB1 (0.43) CA2MAPTPTPN1KMT2ANPC1
SCHEMBL98093 0.84 CA2 (0.45) CA2MAPTPTPN1L3MBTL1KMT2A
SCHEMBL94894 0.84 CA2 (0.47) CA2TP53MAPTPTPN1KMT2A
SCHEMBL132379 0.83 ALDH1A1 (0.45) CA2KMT2ANPC1
SCHEMBL13598458 0.83 CA2 (0.45) CA2MAPTPTPN1L3MBTL1KMT2A
SCHEMBL13598454 0.83 CA2 (0.39) CA2MAPTPTPN1POLB
SCHEMBL95628 0.83 MAPT (0.47) CA2TP53MAPTPTPN1KMT2A
SCHEMBL13598457 0.82 TGM2 (0.39) CA2MAPTPTPN1
SCHEMBL98668 0.82 PTPN1 (0.45) CA2TP53MAPTPTPN1KMT2A
SCHEMBL95913 0.81 CA2 (0.46) CA2TP53MAPTPTPN1KMT2A

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 6 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
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
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 CA2 254/4885TP53 1280/4885MAPT 4773/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 CA2 254/4885TP53 1280/4885MAPT 4773/4885

“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.

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