SCHEMBL93500

SCHEMBL93500

O=C1NC(=S)SC1=Cc1cccc2c1CCC(=O)N2Cc1ccc(Br)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PTP4A3 O75365 3/20 0.53
▸ PIK3CG P48736 10/20 0.51
▸ CISD1 Q9NZ45 2/20 0.47
▸ PIK3C2A O00443 2/20 0.46
▸ PIK3C2B O00750 2/20 0.46
▸ PIK3CA P42336 2/20 0.46
▸ PRKDC P78527 2/20 0.46
▸ PIK3R1 P27986 1/20 0.46
▸ PIK3C3 Q8NEB9 1/20 0.46
▸ PIK3CD O00329 1/20 0.46
▸ PIK3CB P42338 1/20 0.46
▸ PIM1 P11309 2/20 0.46
▸ PDE4B Q07343 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
SCHEMBL93499 1.00 PTP4A3 (0.53) PTP4A3PIK3CGCISD1PIK3C2APIK3C2B
SCHEMBL97198 0.89 PIK3CG (0.52) PTP4A3PIK3CGPIK3C2APIK3C2BPIK3CA
SCHEMBL97199 0.89 PIK3CG (0.52) PTP4A3PIK3CGPIK3C2APIK3C2BPIK3CA
SCHEMBL97974 0.72 CA2 (0.42) —
SCHEMBL14463961 0.68 PTP4A3 (0.64) PTP4A3PIK3CGCISD1PIM1
SCHEMBL13598449 0.67 FFAR1 (0.44) CISD1
SCHEMBL5335927 0.67 PIK3CG (1.00) PIK3CGPIK3C2APIK3C2BPIK3CAPRKDC
SCHEMBL5335930 0.67 PIK3CG (1.00) PIK3CGPIK3C2APIK3C2BPIK3CAPRKDC
SCHEMBL2066107 0.67 PIM1 (0.54) PTP4A3PIK3CGPIM1
SCHEMBL10090251 0.67 PIM1 (0.54) PTP4A3PIK3CGPIM1

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
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
EP-1797082-A1 CARBOSTYRIL COMPOUND Otsuka Pharmaceutical Company, Limited (JP) 2007-06-20 — — EP disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 — — WO 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 PTP4A3 4030/4885PIK3CG 3965/4885CISD1 135/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 PTP4A3 4030/4885PIK3CG 3965/4885CISD1 135/4885

“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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