SCHEMBL12638838

SCHEMBL12638838

CCc1nc2nc(N)cc(-c3cc4cc(CN5CCOCC5)ccc4[nH]3)c2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 16/20 0.48
▸ CDK7 P50613 6/20 0.45
▸ FGFR1 P11362 2/20 0.41
▸ SRC P12931 2/20 0.41
▸ FGFR2 P21802 2/20 0.41
▸ FGFR4 P22455 2/20 0.41
▸ FGFR3 P22607 2/20 0.41
▸ KDR P35968 2/20 0.41
▸ JAK2 O60674 1/20 0.38
▸ CSF1R P07333 1/20 0.38

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
SCHEMBL12638839 0.93 CHEK1 (0.47) CHEK1CDK7FGFR1SRCFGFR2
SCHEMBL12638840 0.91 CHEK1 (0.46) CHEK1CDK7FGFR1SRCFGFR2
SCHEMBL14306666 0.91 CHEK1 (0.48) CHEK1CDK7FGFR1SRCFGFR2
SCHEMBL12638845 0.90 CHEK1 (0.46) CHEK1CDK7FGFR1SRCFGFR2
SCHEMBL12638833 0.89 CHEK1 (0.49) CHEK1CDK7FGFR1SRCFGFR2
SCHEMBL12638841 0.86 CHEK1 (0.48) CHEK1CDK7FGFR1SRCFGFR2
SCHEMBL12638835 0.84 CHEK1 (0.47) CHEK1CDK7FGFR1SRCFGFR2
SCHEMBL12638843 0.84 CHEK1 (0.49) CHEK1CDK7
SCHEMBL12638832 0.83 CHEK1 (0.49) CHEK1CDK7FGFR1SRCFGFR2
SCHEMBL12638850 0.82 CHEK1 (0.51) CHEK1CDK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110105427-A1 DEAZAPURINES AND USES THEREOF DAUN JANE 2011-05-05 — — US disclosed
US-7868002-B2 Deazapurines and uses thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-01-11 — — US disclosed
US-7868002-B2 Deazapurines and uses thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-01-11 — — US disclosed
US-20080103137-A1 Deazapurines and uses thereof EISAI CO., LTD. 2008-05-01 — — US disclosed
US-20080103137-A1 Deazapurines and uses thereof EISAI CO., LTD. 2008-05-01 — — US disclosed
US-7314936-B2 Deazapurines and uses thereof EISAI CO., LTD. (JP) 2008-01-01 — — US disclosed
US-7314936-B2 Deazapurines and uses thereof EISAI CO., LTD. (JP) 2008-01-01 — — 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 (2 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-20110105427-A1 DEAZAPURINES AND USES THEREOF TPMT, CD38, CD2 CHEK1 1272/4885CDK7 259/4885FGFR1 1445/4885
US-20080103137-A1 Deazapurines and uses thereof TPMT, TYMP, ENTPD5 CHEK1 3404/4885CDK7 214/4885FGFR1 2910/4885

“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.

Send feedback