SCHEMBL9957428

SCHEMBL9957428

Cc1ccc(-c2cn3nc(-c4cccc(CO)n4)ccc3n2)cc1NC(=O)C(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 9/20 0.40
CSNK1E P49674 9/20 0.40
TP53 P04637 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
RIPK1 Q13546 2/20 0.38
MAPT P10636 2/20 0.37
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 1/20 0.37
MAPK14 Q16539 1/20 0.36
SMO Q99835 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL9956586 0.87 CSNK1D (0.41) CSNK1DCSNK1ETP53RXFP1RIPK1
SCHEMBL9956235 0.86 CSNK1D (0.42) CSNK1DCSNK1ETP53RXFP1RIPK1
SCHEMBL9956786 0.83 CSNK1D (0.42) CSNK1DCSNK1ERIPK1MAPTPOLB
SCHEMBL9956458 0.83 CSNK1D (0.42) CSNK1DCSNK1ERIPK1MAPT
SCHEMBL9957320 0.83 AURKA (0.47) CSNK1DCSNK1ETP53RIPK1MAPT
SCHEMBL9957565 0.82 CSNK1D (0.44) CSNK1DCSNK1ETP53RXFP1RIPK1
SCHEMBL9957191 0.82 CSNK1D (0.43) CSNK1DCSNK1ETP53RIPK1MAPT
SCHEMBL9956705 0.81 CSNK1D (0.42) CSNK1DCSNK1ETP53RIPK1MAPT
SCHEMBL9957221 0.81 CSNK1D (0.44) CSNK1DCSNK1ETP53RXFP1RIPK1
SCHEMBL9957147 0.81 CSNK1D (0.44) CSNK1DCSNK1ETP53RXFP1RIPK1

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-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 claimed
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 852/4885TP53 10/4885

“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.