SCHEMBL3263536

SCHEMBL3263536

Cc1cccc2c(-c3nc4[nH]nc(NC(=O)C5CC5)c4cc3F)cnn12

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 20/20 0.52
GSK3A P49840 19/20 0.52
CDK2 P24941 4/20 0.49
ADORA2A P29274 1/20 0.47
ADORA1 P30542 1/20 0.47
MYLK Q15746 1/20 0.44
MARK1 Q9P0L2 1/20 0.44
PIM2 Q9P1W9 1/20 0.44

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
SCHEMBL3263415 0.96 GSK3B (0.49) GSK3BGSK3ACDK2ADORA2AADORA1
SCHEMBL8043843 0.85 GSK3A (0.58) GSK3BGSK3ACDK2ADORA2AADORA1
SCHEMBL8043844 0.81 GSK3A (0.54) GSK3BGSK3ACDK2ADORA2AADORA1
SCHEMBL13099648 0.81 FGFR1 (0.43) GSK3BCDK2
SCHEMBL3265538 0.80 GRM5 (0.43) GSK3BCDK2
SCHEMBL3231677 0.79 GSK3B (0.49) GSK3BGSK3ACDK2ADORA2AADORA1
SCHEMBL8048684 0.70 ROCK1 (0.46) GSK3BGSK3A
SCHEMBL8043054 0.69 EPHB3 (0.47) GSK3BGSK3A
SCHEMBL13099726 0.69 EGFR (0.39) GSK3BGSK3ACDK2ADORA2AADORA1
SCHEMBL8031088 0.69 CDK2 (0.41) GSK3BGSK3ACDK2PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256133-A1 NOVEL COMPOUNDS HAVING INDAZOLE FRAMEWORKS, METHODS FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHOONGWAE PHARMA CORPORATION (KR) 2010-10-07 US disclosed
US-20100256133-A1 NOVEL COMPOUNDS HAVING INDAZOLE FRAMEWORKS, METHODS FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHOONGWAE PHARMA CORPORATION (KR) 2010-10-07 US disclosed
US-20100256133-A1 NOVEL COMPOUNDS HAVING INDAZOLE FRAMEWORKS, METHODS FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHOONGWAE PHARMA CORPORATION (KR) 2010-10-07 US disclosed
WO-2010027114-A1 USE OF PYRAZOLE-PYRIDINE DERIVATIVES AND ITS SALTS FOR TREATING OR REVENTIN OSTEOPOROSIS CHOONGWAE PHARMA CORPORATION (KR) 2010-03-11 WO disclosed
WO-2009038385-A2 NOVEL COMPOUNDS HAVING INDAZOLE FRAMEWORKS, METHODS FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHOONGWAE PHARMA CORPORATION (KR) 2009-03-26 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-20100256133-A1 NOVEL COMPOUNDS HAVING INDAZOLE FRAMEWORKS, METHODS FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME MAP3K20, MAP3K3, MAP3K1 GSK3B 208/4885GSK3A 206/4885CDK2 82/4885

“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.