SCHEMBL9956767

SCHEMBL9956767

Cc1ccc(-c2cn3nc(-c4ccc(/C(N)=N\O)cc4C(F)(F)F)ccc3n2)cc1NC(=O)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 11/20 0.38
CSNK1E P49674 11/20 0.38
PIK3CA P42336 1/20 0.37
RXFP1 Q9HBX9 1/20 0.36
RIPK1 Q13546 3/20 0.34
WDR5 P61964 1/20 0.34
MAPT P10636 1/20 0.34
NTRK1 P04629 1/20 0.33

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
SCHEMBL10284743 1.00 CSNK1D (0.38) CSNK1DCSNK1EPIK3CARXFP1RIPK1
SCHEMBL9956769 1.00 CSNK1D (0.38) CSNK1DCSNK1EPIK3CARXFP1RIPK1
SCHEMBL9956220 0.94 NTRK1 (0.38) CSNK1DCSNK1EPIK3CARXFP1NTRK1
SCHEMBL9956223 0.94 NTRK1 (0.38) CSNK1DCSNK1EPIK3CARXFP1NTRK1
SCHEMBL9956915 0.92 CSNK1D (0.40) CSNK1DCSNK1EPIK3CARXFP1RIPK1
SCHEMBL9955361 0.91 CSNK1D (0.38) CSNK1DCSNK1ERIPK1MAPT
SCHEMBL9955358 0.91 CSNK1D (0.38) CSNK1DCSNK1ERIPK1MAPT
SCHEMBL9955806 0.91 CSNK1D (0.39) CSNK1DCSNK1EPIK3CARXFP1RIPK1
SCHEMBL9955676 0.91 CSNK1D (0.40) CSNK1DCSNK1ERIPK1MAPT
SCHEMBL9955678 0.91 CSNK1D (0.40) CSNK1DCSNK1ERIPK1MAPT

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 6 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
US-8871767-B2 2-arylimidazo[1,2-B]pyridazine, 2-phenylimidazo[1,2-A]pyridine, and 2-phenylimidazo[1,2-A]pyrazine derivatives HENGRUI (USA) LTD. (US) 2014-10-28 US disclosed
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 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 852/4885PIK3CA 475/4885

“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.