SCHEMBL2717451

SCHEMBL2717451

COc1nc(Nc2ccc(N3CCOCC3)cc2)nc(Nc2cccc(C)c2)c1C(N)=O

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 4/20 0.55
▸ MAPT P10636 3/20 0.52
▸ TP53 P04637 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ CA12 O43570 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ CA9 Q16790 1/20 0.51
▸ STAT6 P42226 2/20 0.51
▸ CSF1R P07333 2/20 0.51
▸ PKMYT1 Q99640 3/20 0.49
▸ BRD4 O60885 1/20 0.48
▸ LCK P06239 2/20 0.48
▸ MAPK1 P28482 1/20 0.47
▸ BTK Q06187 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ GBA1 P04062 1/20 0.47

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
SCHEMBL2718800 0.90 SYK (0.69) SYK
SCHEMBL2716317 0.82 SYK (0.67) SYK
SCHEMBL2717457 0.78 SYK (0.72) SYK
SCHEMBL10271732 0.77 SYK (0.49) SYKSTAT6
SCHEMBL14355350 0.73 MAPT (0.56) SYKMAPTTP53POLBCA12
SCHEMBL12617253 0.73 CHEK1 (0.59) SYKMAPTTP53POLBCA12
SCHEMBL2716506 0.72 SYK (0.69) SYK
SCHEMBL763271 0.71 SYK (0.88) SYKBRD4MAPK1
SCHEMBL764071 0.71 SYK (0.71) SYKSTAT6MAPK1
SCHEMBL10241937 0.71 SYK (0.78) SYKSTAT6BRD4MAPK1

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
US-20130317029-A1 OXYPYRIMIDINES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-11-28 — — US claimed
US-20130317029-A1 OXYPYRIMIDINES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-11-28 — — US disclosed
WO-2012061415-A1 OXYPYRIMIDINES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 — — WO 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-20130317029-A1 OXYPYRIMIDINES AS SYK MODULATORS SYK, BTK, FYN SYK 1/4885MAPT 891/4885TP53 1622/4885

“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.

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