SCHEMBL97248

SCHEMBL97248

COc1ccc(C=C2SC(=O)NC2=O)c2c1N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.50
▸ MGAM O43451 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ SI P14410 1/20 0.47
▸ MGAM2 Q2M2H8 1/20 0.47
▸ MAPT P10636 3/20 0.47
▸ MCL1 Q07820 2/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ GFER P55789 1/20 0.47
▸ ESRRA P11474 4/20 0.46
▸ BLM P54132 2/20 0.45
▸ PTPN1 P18031 1/20 0.42
▸ ENPP2 Q13822 2/20 0.41
▸ PIM1 P11309 1/20 0.40

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
SCHEMBL97246 1.00 HPGD (0.50) HPGDMGAMGAASIMGAM2
SCHEMBL96966 0.84 PIM1 (0.52) HPGDKMT2AESRRAPTPN1ENPP2
SCHEMBL96964 0.84 PIM1 (0.52) HPGDKMT2AESRRAPTPN1ENPP2
SCHEMBL98464 0.75 CA2 (0.43) HPGDGAAMAPTNPSR1MEN1
SCHEMBL98322 0.73 NAT1 (0.49) HPGDGAAMAPTMCL1MEN1
SCHEMBL98320 0.73 NAT1 (0.49) HPGDGAAMAPTMCL1MEN1
SCHEMBL97250 0.69 BRD4 (0.48) GAAMAPTNPSR1MEN1POLB
SCHEMBL5297293 0.68 BRD4 (0.47) GAAMAPTNPSR1MEN1POLB
SCHEMBL13846861 0.68 HPGD (0.81) HPGDMGAMGAASIMGAM2
SCHEMBL5297286 0.67 BRD4 (0.46) GAAMAPTNPSR1MEN1POLB

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 HPGD 2322/4885MGAM 3166/4885GAA 4784/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 HPGD 2322/4885MGAM 3166/4885GAA 4784/4885

“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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