SCHEMBL9957437

SCHEMBL9957437

Cc1ccc(-c2cn3nc(-c4cccc(O)c4C(F)(F)F)ccc3n2)cc1NC(=O)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 10/20 0.41
CSNK1E P49674 10/20 0.41
TTK P33981 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
RIPK1 Q13546 3/20 0.36
PIK3CA P42336 2/20 0.36
PIK3CD O00329 1/20 0.36
PIK3CB P42338 1/20 0.36
PIK3CG P48736 1/20 0.36
MAPT P10636 1/20 0.36
LRRK2 Q5S007 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
SCHEMBL9956062 0.92 CSNK1D (0.42) CSNK1DCSNK1ERXFP1RIPK1
SCHEMBL9956705 0.90 CSNK1D (0.42) CSNK1DCSNK1ETTKRIPK1PIK3CA
SCHEMBL9956448 0.87 RXFP1 (0.46) CSNK1DCSNK1ETTKRXFP1RIPK1
SCHEMBL9956160 0.85 CSNK1D (0.45) CSNK1DCSNK1ERXFP1RIPK1
SCHEMBL9956740 0.85 CSNK1D (0.42) CSNK1DCSNK1ERIPK1MAPT
SCHEMBL9956293 0.85 CSNK1D (0.39) CSNK1DCSNK1ERXFP1RIPK1MAPT
SCHEMBL9956973 0.84 FYN (0.44) CSNK1DCSNK1ERXFP1RIPK1
SCHEMBL10277472 0.84 CSNK1D (0.39) CSNK1DCSNK1ERIPK1MAPT
SCHEMBL9955987 0.84 CSNK1D (0.41) CSNK1DCSNK1ERXFP1RIPK1PIK3CA
SCHEMBL9956483 0.84 CSNK1D (0.41) CSNK1DCSNK1ERXFP1RIPK1PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2635578-A1 2-ARYLIMIDAZO[1,2-B]PYRIDAZINE, 2-PHENYLIMIDAZO[1,2-A]PYRIDINE, AND 2-PHENYLIMIDAZO[1,2-A]PYRAZINE DERIVATIVES Hengrui (USA) Ltd. (US) 2013-09-11 EP claimed
US-20120178751-A1 2-ARYLIMIDAZO[1,2-B]PYRIDAZINE, 2-PHENYLIMIDAZO[1,2-A]PYRIDINE, AND 2-PHENYLIMIDAZO[1,2-A]PYRAZINE DERIVATIVES HENGRUI (USA), LTD. 2012-07-12 US claimed
WO-2012088411-A1 2-ARYLIMIDAZO[1,2-B]PYRIDAZINE, 2-PHENYLIMIDAZO[1,2-A]PYRIDINE, AND 2-PHENYLIMIDAZO[1,2-A]PYRAZINE DERIVATIVES PAMLICO PHARMACEUTICAL INC. (US) 2012-06-28 WO claimed
EP-2635578-B1 2-ARYLIMIDAZO[1,2-B]PYRIDAZINE, 2-PHENYLIMIDAZO[1,2-A]PYRIDINE, AND 2-PHENYLIMIDAZO[1,2-A]PYRAZINE DERIVATIVES HENGRUI USA LTD (US) 2015-12-16 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 (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-20120178751-A1 2-ARYLIMIDAZO[1,2-B]PYRIDAZINE, 2-PHENYLIMIDAZO[1,2-A]PYRIDINE, AND 2-PHENYLIMIDAZO[1,2-A]PYRAZINE DERIVATIVES PRXL2A, CDK2, CCNA2 CSNK1D 655/4885CSNK1E 852/4885TTK 3789/4885

“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.