SCHEMBL12110270

SCHEMBL12110270

CCc1nc(C)nc(N2CCOCC2)n1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ KMT2A Q03164 2/20 0.46
▸ HRH4 Q9H3N8 2/20 0.45
▸ KDM4E B2RXH2 3/20 0.44
▸ HTT P42858 1/20 0.44
▸ ALDH1A1 P00352 4/20 0.43
▸ HPGD P15428 1/20 0.43
▸ NUDT1 P36639 1/20 0.42
▸ CRHR1 P34998 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41

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
SCHEMBL12110268 0.83 KMT2A (0.56) SMN1; SMN2MAPK1KMT2AHRH4KDM4E
SCHEMBL9619196 0.83 KDM4E (0.58) SMN1; SMN2MAPK1KMT2AHRH4KDM4E
SCHEMBL15386251 0.81 MAPT (0.50) SMN1; SMN2MAPK1KMT2AHRH4KDM4E
SCHEMBL28692486 0.77 HTT (0.53) SMN1; SMN2HRH4KDM4EHTTALDH1A1
SCHEMBL15386410 0.77 ALDH1A1 (0.62) SMN1; SMN2MAPK1KMT2AKDM4EHTT
SCHEMBL9066172 0.76 ALDH1A1 (0.66) SMN1; SMN2KMT2AKDM4EHTTALDH1A1
SCHEMBL17309194 0.75 HRH4 (0.66) SMN1; SMN2KMT2AHRH4KDM4EHTT
SCHEMBL2689185 0.75 KMT2A (0.49) SMN1; SMN2MAPK1KMT2AHRH4KDM4E
SCHEMBL912709 0.75 MAPT (0.54) SMN1; SMN2MAPK1KMT2AHRH4KDM4E
SCHEMBL14641243 0.75 MAPK1 (0.49) SMN1; SMN2MAPK1KMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8921361-B2 Triazine, pyrimidine and pyridine analogs and their use as therapeutic agents and diagnostic probes UNIVERSITY OF BASEL (CH) 2014-12-30 — — US disclosed
US-20110275762-A1 TRIAZINE, PYRIMIDINE AND PYRIDINE ANALOGS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES UNIVERSITY OF BASEL (CH) 2011-11-10 — — 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-20110275762-A1 TRIAZINE, PYRIMIDINE AND PYRIDINE ANALOGS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES MTOR, PIK3CA, PIK3CD SMN1; SMN2 2486/4885MAPK1 216/4885KMT2A 4567/4885

“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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