SCHEMBL97131

SCHEMBL97131

COC(=O)c1ccc(CN2C(=O)CCc3c(C=O)ccc(OC)c32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.43
▸ HPGD P15428 2/20 0.43
▸ HTT P42858 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ERN1 O75460 1/20 0.40
▸ ENPP2 Q13822 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ ACHE P22303 1/20 0.39
▸ FAAH O00519 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ PDE4A P27815 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ PDE4C Q08493 1/20 0.38
▸ PDE4D Q08499 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38

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
SCHEMBL97250 0.85 BRD4 (0.48) ALDH1A1HTTLMNASMN1; SMN2POLB
SCHEMBL5297293 0.84 BRD4 (0.47) ALDH1A1HTTLMNASMN1; SMN2POLB
SCHEMBL96966 0.83 PIM1 (0.52) HPGDENPP2KMT2APTPN1
SCHEMBL96964 0.83 PIM1 (0.52) HPGDENPP2KMT2APTPN1
SCHEMBL5297286 0.83 BRD4 (0.46) ALDH1A1HTTLMNASMN1; SMN2POLB
SCHEMBL5289604 0.81 BRD4 (0.43) ALDH1A1HTTNPC1RAB9APOLB
SCHEMBL98450 0.78 ALDH1A1 (0.37) ALDH1A1HPGDNPC1RAB9APOLB
SCHEMBL98191 0.77 MTNR1A (0.34) ALDH1A1HPGDKDM4EKMT2A
SCHEMBL98120 0.73 CYP11B1 (0.40) ALDH1A1HPGDNPC1ERN1KMT2A
SCHEMBL97451 0.73 BRD4 (0.35) SMN1; SMN2POLBACHEPDE4APDE4B

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 ALDH1A1 2458/4885HPGD 2322/4885HTT 4175/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 ALDH1A1 2458/4885HPGD 2322/4885HTT 4175/4885

“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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