SCHEMBL2410481

SCHEMBL2410481

CC(C(=O)Cl)c1ccccc1C#N

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 5/20 0.40
TSHR P16473 3/20 0.39
LMNA P02545 1/20 0.38
GAA P10253 4/20 0.36
KDM4E B2RXH2 3/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
KCNA5 P22460 1/20 0.35
PDK1 Q15118 1/20 0.35
PDK2 Q15119 1/20 0.35
PDK3 Q15120 1/20 0.35
PDK4 Q16654 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL31561697 0.84 L3MBTL1 (0.45) L3MBTL1MAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL7050570 0.84 L3MBTL1 (0.45) L3MBTL1MAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL15559998 0.82 CXCL8 (0.44) L3MBTL1MAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL11273707 0.80 L3MBTL1 (0.45) L3MBTL1MAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL26661047 0.77 GAA (0.50) L3MBTL1MAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL16811764 0.76 LMNA (0.40) L3MBTL1MAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL536175 0.75 TSHR (0.46) L3MBTL1MAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL343227 0.75 TSHR (0.46) L3MBTL1MAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL8390663 0.75 TSHR (0.46) L3MBTL1MAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL29835035 0.74 TSHR (0.50) L3MBTL1MAPK1SMN1; SMN2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1559716-B1 PYRAZOLONAPHTHYRIDINE DERIVATIVE ASKA PHARM CO LTD (JP) 2011-09-14 EP disclosed
US-20100093782-A1 Pyrazolonaphthyridine derivatives KANAZAWA HASHIME 2010-04-15 US disclosed
CN-100572381-C Pyrazolonaphthyridine derivative ASKA PHARM CO LTD (JP) 2009-12-23 CN disclosed
US-7608716-B2 Pyrazolonaphthyridine derivative ASKA PHARMACEUTICAL CO., LTD. (JP) 2009-10-27 US disclosed
US-20060040972-A1 Pyrazolonaphthyridine derivative ASKA PHARMACEUTICAL CO., LTD. (JP) 2006-02-23 US disclosed
CN-1717409-A Pyrazolonaphthyridine derivative GRELAN PHARMACEUTICAL CO (JP) 2006-01-04 CN disclosed
EP-1559716-A1 PYRAZOLONAPHTHYRIDINE DERIVATIVE Grelan Pharmaceutical Co., Ltd. (JP) 2005-08-03 EP 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-20060040972-A1 Pyrazolonaphthyridine derivative PDE3B, PDE3A, PDE4A L3MBTL1 3564/4885MAPK1 561/4885SMN1; SMN2 3740/4885
US-20100093782-A1 Pyrazolonaphthyridine derivatives PDE3B, PDE3A, PDE4A L3MBTL1 3594/4885MAPK1 560/4885SMN1; SMN2 3686/4885

“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.