SCHEMBL9956449

SCHEMBL9956449

Cc1ccc(-c2cn3nc(-c4c(C)nn(C)c4C)ccc3n2)cc1NC(=O)C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 12/20 0.43
CSNK1E P49674 12/20 0.43
MAPK14 Q16539 1/20 0.39
SMO Q99835 1/20 0.39
RIPK1 Q13546 2/20 0.37
MAPT P10636 2/20 0.37
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
PIK3CG P48736 1/20 0.35
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
TTK P33981 1/20 0.34

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
SCHEMBL9955578 0.84 CSNK1D (0.41) CSNK1DCSNK1ERIPK1MAPT
SCHEMBL9956109 0.84 CSNK1D (0.43) CSNK1DCSNK1ERIPK1MAPTPIK3CD
SCHEMBL9957565 0.84 CSNK1D (0.44) CSNK1DCSNK1ERIPK1MAPTPIK3CD
SCHEMBL9957147 0.83 CSNK1D (0.44) CSNK1DCSNK1ERIPK1MAPTPIK3CA
SCHEMBL9957221 0.83 CSNK1D (0.44) CSNK1DCSNK1ERIPK1MAPTLMNA
SCHEMBL9956538 0.82 MAPT (0.46) CSNK1DCSNK1ERIPK1MAPTPIK3CD
SCHEMBL10277119 0.82 CSNK1D (0.40) CSNK1DCSNK1ERIPK1MAPTPIK3CD
SCHEMBL9956921 0.81 CSNK1D (0.42) CSNK1DCSNK1ERIPK1MAPTPIK3CA
SCHEMBL9956586 0.81 CSNK1D (0.41) CSNK1DCSNK1ERIPK1MAPTLMNA
SCHEMBL9956116 0.81 CSNK1D (0.41) CSNK1DCSNK1ERIPK1MAPTPIK3CD

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 852/4885MAPK14 3647/4885

“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.