SCHEMBL10277069

SCHEMBL10277069

CC/C(=C\c1cccc(C(=O)Nc2cc(-c3cn4nc(-c5cccnc5C(F)(F)F)ccc4n3)ccc2C)c1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
GLA P06280 2/20 0.40
GAA P10253 2/20 0.40
LMNA P02545 1/20 0.40
EPHX2 P34913 1/20 0.40
POLB P06746 3/20 0.39
CSNK1D P48730 7/20 0.38
CSNK1E P49674 7/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
MAPK14 Q16539 3/20 0.38
SMO Q99835 3/20 0.38
KDR P35968 1/20 0.37
BRAF P15056 1/20 0.37
RIPK1 Q13546 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
SCHEMBL10277075 1.00 KDM4E (0.40) KDM4EALDH1A1GLAGAALMNA
SCHEMBL10277392 0.88 ALDH1A1 (0.42) KDM4EALDH1A1GLAGAALMNA
SCHEMBL10277391 0.88 ALDH1A1 (0.42) KDM4EALDH1A1GLAGAALMNA
SCHEMBL10277070 0.87 POLB (0.41) KDM4EALDH1A1GLAGAALMNA
SCHEMBL10308715 0.87 POLB (0.41) KDM4EALDH1A1GLAGAALMNA
SCHEMBL10277229 0.87 ALDH1A1 (0.44) KDM4EALDH1A1GLAGAALMNA
SCHEMBL10277073 0.86 KDM4E (0.41) KDM4EALDH1A1GLAGAALMNA
SCHEMBL9956531 0.86 ALDH1A1 (0.41) KDM4EALDH1A1GLAGAALMNA
SCHEMBL9956529 0.86 ALDH1A1 (0.41) KDM4EALDH1A1GLAGAALMNA
SCHEMBL10276929 0.86 EPHX2 (0.42) KDM4EALDH1A1GLAGAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 KDM4E 2693/4885ALDH1A1 334/4885GLA 1459/4885

“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.