SCHEMBL1720874

SCHEMBL1720874

O=C1c2ccccc2C(=O)N1C1CCCC(c2cccnc2)C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.50
ALDH1A1 P00352 6/20 0.45
OPRM1 P35372 1/20 0.44
OPRL1 P41146 1/20 0.44
NAMPT P43490 1/20 0.43
KDM4E B2RXH2 4/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.41
TRPV6 Q9H1D0 2/20 0.41
TNKS O95271 1/20 0.41
CYP19A1 P11511 1/20 0.40
CYP3A4 P08684 1/20 0.39
THRB P10828 1/20 0.39
TSHR P16473 1/20 0.39
THPO P40225 1/20 0.39
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL1720878 1.00 CYP11B2 (0.50) CYP11B2ALDH1A1OPRM1OPRL1NAMPT
SCHEMBL1720877 1.00 CYP11B2 (0.50) CYP11B2ALDH1A1OPRM1OPRL1NAMPT
SCHEMBL1721775 1.00 CYP11B2 (0.50) CYP11B2ALDH1A1OPRM1OPRL1NAMPT
SCHEMBL1721426 1.00 CYP11B2 (0.50) CYP11B2ALDH1A1OPRM1OPRL1NAMPT
SCHEMBL3091992 0.92 OPRM1 (0.48) CYP11B2ALDH1A1OPRM1OPRL1NAMPT
SCHEMBL3091989 0.92 OPRM1 (0.48) CYP11B2ALDH1A1OPRM1OPRL1NAMPT
SCHEMBL13153724 0.84 TNKS (0.52) CYP11B2ALDH1A1OPRM1OPRL1NAMPT
SCHEMBL13833169 0.79 ALDH1A1 (0.40) ALDH1A1GAAHTTCYP3A4LMNA
SCHEMBL13833170 0.79 ALDH1A1 (0.40) ALDH1A1GAAHTTCYP3A4LMNA
SCHEMBL1723397 0.79 ALDH1A1 (0.40) ALDH1A1GAAHTTCYP3A4LMNA

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2406266-B1 7-CYCLOALKYLAMINOQUINOLONES AS GSK-3 INHIBITORS KYORIN SEIYAKU KK (JP) 2013-12-25 EP disclosed
EP-2406266-A1 7-CYCLOALKYLAMINOQUINOLONES AS GSK-3 INHIBITORS Kyorin Pharmaceutical Co., Ltd. (JP) 2012-01-18 EP disclosed
US-8071591-B2 7-cycloalkylaminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-12-06 US disclosed
US-8071591-B2 7-cycloalkylaminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-12-06 US disclosed
US-8071591-B2 7-cycloalkylaminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-12-06 US disclosed
US-20100234367-A1 7-CYCLOALKYLAMINOQUINOLONES AS GSK-3 INHIBITORS Kyorin Pharmaceuticals Co. Ltd 2010-09-16 US disclosed
US-20100234367-A1 7-CYCLOALKYLAMINOQUINOLONES AS GSK-3 INHIBITORS Kyorin Pharmaceuticals Co. Ltd 2010-09-16 US disclosed
US-20100234367-A1 7-CYCLOALKYLAMINOQUINOLONES AS GSK-3 INHIBITORS Kyorin Pharmaceuticals Co. Ltd 2010-09-16 US disclosed
WO-2010104205-A1 7-CYCLOALKYLAMINOQUINOLONES AS GSK-3 INHIBITORS KYORIN PHARMACEUTICAL CO., LTD. (JP) 2010-09-16 WO disclosed
WO-2010104205-A1 7-CYCLOALKYLAMINOQUINOLONES AS GSK-3 INHIBITORS KYORIN PHARMACEUTICAL CO., LTD. (JP) 2010-09-16 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 (1 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-20100234367-A1 7-CYCLOALKYLAMINOQUINOLONES AS GSK-3 INHIBITORS GSK3B, GSK3A, GSKIP CYP11B2 341/4885ALDH1A1 3225/4885OPRM1 4336/4885

“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.