SCHEMBL10005967

SCHEMBL10005967

CCOC(=O)c1cc(N)nn1C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.41
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ KDM4E B2RXH2 4/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ HSD17B10 Q99714 3/20 0.39
▸ ALOX15 P16050 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ PTGER4 P35408 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ MAOA P21397 1/20 0.38
▸ POLB P06746 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ PDE4D Q08499 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL2545801 0.85 ALDH1A1 (0.39) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL286585 0.78 LMNA (0.50) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
Hydrochloric Acid SCHEMBL286584 0.77 LMNA (0.49) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL10295030 0.77 MAPT (0.42) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL25033914 0.75 ADORA3 (0.43) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL1566850 0.72 ALDH1A1 (0.44) SMN1; SMN2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL19475586 0.71 ALDH1A1 (0.59) SMN1; SMN2KDM4EALDH1A1HSD17B10ALOX15
SCHEMBL21963082 0.71 NPC1 (0.49) SMN1; SMN2NPC1KDM4EALDH1A1HSD17B10
SCHEMBL29047841 0.70 ELANE (0.46) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL18007580 0.70 SMN1; SMN2 (0.71) SMN1; SMN2RAB9AKDM4EALDH1A1HSD17B10

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
CN-107708690-B Pyrimidine derivatives as kinase inhibitors and their therapeutic use 常山凯捷健生物药物研发(河北)有限公司 2021-09-14 — — CN disclosed
EP-3261637-B1 PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS AND THEIR THERAPEUTICAL APPLICATIONS NANTBIOSCIENCE INC (US) 2021-05-26 — — EP disclosed
US-10766879-B2 Pyrimidine derivatives as kinase inhibitors and their therapeutical applications NANTBIOSCIENCE, INC. (US) 2020-09-08 — — US disclosed
US-20180155327-A1 PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS AND THEIR THERAPEUTICAL APPLICATIONS NANTBIOSCIENCE, INC. 2018-06-07 — — US disclosed
US-20120172361-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CALIFORNIA CAPITAL EQUITY, LLC (US) 2012-07-05 — — 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 (3 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-20120172361-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CYP3A5, CYP11B2, ABCB1 SMN1; SMN2 1130/4885NPC1 87/4885RAB9A 3470/4885
US-10766879-B2 Pyrimidine derivatives as kinase inhibitors and their therapeutical applications DCK, TK1, DTYMK SMN1; SMN2 3004/4885NPC1 2718/4885RAB9A 2628/4885
US-20180155327-A1 PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS AND THEIR THERAPEUTICAL APPLICATIONS DCK, TK1, DTYMK SMN1; SMN2 3004/4885NPC1 2718/4885RAB9A 2628/4885

“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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