SCHEMBL97251

SCHEMBL97251

CCOC(=O)C(CCCc1ccc(OC)c2c1ccc(=O)n2C)C(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.40
TDP1 Q9NUW8 4/20 0.40
MAPK1 P28482 4/20 0.40
TSHR P16473 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP19A1 P11511 3/20 0.36
NQO2 P16083 3/20 0.36
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PTPN1 P18031 2/20 0.35
MAPT P10636 1/20 0.34
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34
TNF P01375 1/20 0.33
BLM P54132 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL97855 0.93 CYP19A1 (0.38) L3MBTL1TDP1MAPK1TSHRALDH1A1
SCHEMBL97980 0.86 ALDH1A1 (0.41) MAPK1TSHRALDH1A1KMT2ACYP19A1
SCHEMBL132509 0.77 CYP19A1 (0.40) MAPK1TSHRALDH1A1KMT2ACYP19A1
SCHEMBL98053 0.77 CYP19A1 (0.36) TSHRALDH1A1MEN1KMT2ACYP19A1
SCHEMBL96811 0.76 KMT2A (0.38) MAPK1TSHRALDH1A1MEN1KMT2A
SCHEMBL98162 0.74 CYP19A1 (0.39) MAPK1TSHRALDH1A1KMT2ACYP19A1
SCHEMBL98475 0.74 CYP19A1 (0.37) ALDH1A1MEN1KMT2ACYP19A1NQO2
SCHEMBL11202443 0.72 L3MBTL1 (0.47) L3MBTL1TDP1MAPK1TSHRALDH1A1
SCHEMBL98644 0.71 KMT2A (0.46) MAPK1TSHRALDH1A1KMT2ACYP19A1
SCHEMBL97252 0.70 CA2 (0.45) ALDH1A1CYP19A1NQO2SMN1; SMN2PTPN1

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 L3MBTL1 262/4885TDP1 4079/4885MAPK1 982/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 L3MBTL1 262/4885TDP1 4079/4885MAPK1 982/4885

“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.