SCHEMBL2323756

SCHEMBL2323756

CNc1nnc(-c2ccccc2)c(-c2ccccc2)n1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.67
▸ GAA P10253 2/20 0.67
▸ SMN1; SMN2 Q16637 2/20 0.67
▸ KDM4E B2RXH2 1/20 0.67
▸ LMNA P02545 1/20 0.67
▸ NUDT1 P36639 1/20 0.58
▸ POLB P06746 1/20 0.57
▸ ADORA1 P30542 9/20 0.56
▸ ADORA2A P29274 3/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.52
▸ GPR84 Q9NQS5 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ ADORA2B P29275 2/20 0.49

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
SCHEMBL11108867 0.80 GAA (1.00) ALDH1A1GAASMN1; SMN2KDM4ELMNA
SCHEMBL31498236 0.79 SMN1; SMN2 (0.61) ALDH1A1GAASMN1; SMN2KDM4ELMNA
SCHEMBL31582535 0.78 POLB (0.67) ALDH1A1GAASMN1; SMN2KDM4ELMNA
SCHEMBL21621282 0.77 NUDT1 (0.44) ALDH1A1GAASMN1; SMN2KDM4ELMNA
SCHEMBL31582349 0.74 POLB (0.55) ALDH1A1GAASMN1; SMN2KDM4ELMNA
SCHEMBL11272208 0.74 GAA (0.60) ALDH1A1GAASMN1; SMN2KDM4ELMNA
SCHEMBL2321152 0.74 GPR84 (0.55) ALDH1A1GAASMN1; SMN2KDM4ELMNA
SCHEMBL27763968 0.73 NUDT1 (1.00) ALDH1A1GAAKDM4ELMNANUDT1
SCHEMBL19454785 0.73 TDP1 (0.61) ALDH1A1GAASMN1; SMN2KDM4ELMNA
SCHEMBL31582295 0.73 KCNH3 (0.54) ALDH1A1GAASMN1; SMN2KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12054472-B2 1,2,4-triazine-4-amine derivatives NXERA PHARMA UK LIMITED (GB) 2024-08-06 — — US disclosed
US-20230021177-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES NXERA PHARMA UK LIMITED (GB) 2023-01-19 — — US disclosed
US-10988455-B2 1,2,4-triazine-4-amine derivatives HEPTARES THERAPEUTICS LIMITED (GB) 2021-04-27 — — US disclosed
US-20190047978-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES NXERA PHARMA UK LIMITED (GB) 2019-02-14 — — US disclosed
US-10112923-B2 1,2,4-triazine-4-amine derivatives HEPTARES THERAPEUTICS LIMITED (GB) 2018-10-30 — — US disclosed
US-20170291888-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES NXERA PHARMA UK LIMITED (GB) 2017-10-12 — — US disclosed
US-20160175314-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES HEPTARES THERAPEUTICS LIMITED (GB) 2016-06-23 — — US disclosed
EP-2531492-B1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES HEPTARES THERAPEUTICS LTD (GB) 2016-04-13 — — EP disclosed
US-9249130-B2 1,2,4-triazine-4-amine derivatives HEPTARES THERAPEUTICS LIMITED (GB) 2016-02-02 — — US disclosed
US-20150005276-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES NXERA PHARMA UK LIMITED (GB) 2015-01-01 — — US disclosed
US-8809525-B2 1,2,4-triazine-4-amine derivatives HEPTARES THERAPEUTICS LIMITED (GB) 2014-08-19 — — US disclosed
US-20130029963-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES HEPTARES THERAPEUTICS LIMITED (GB) 2013-01-31 — — US disclosed
EP-2531492-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES Heptares Therapeutics Limited (GB) 2012-12-12 — — EP disclosed
WO-2011095625-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES HEPTARES THERAPEUTICS LIMITED (GB) 2011-08-11 — — 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 (9 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-20150005276-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES ADORA2B, ADORA2A, ADORA1 ALDH1A1 784/4885GAA 4717/4885SMN1; SMN2 3817/4885
US-20190047978-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES ADORA2B, ADORA2A, ADORA1 ALDH1A1 784/4885GAA 4717/4885SMN1; SMN2 3817/4885
US-10988455-B2 1,2,4-triazine-4-amine derivatives ADORA2B, ADORA2A, ADORA1 ALDH1A1 784/4885GAA 4717/4885SMN1; SMN2 3817/4885
US-20160175314-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES ADORA2B, ADORA2A, ADORA1 ALDH1A1 794/4885GAA 4699/4885SMN1; SMN2 3850/4885
US-20230021177-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES ADORA2B, ADORA2A, ADORA1 ALDH1A1 788/4885GAA 4759/4885SMN1; SMN2 3598/4885
US-10112923-B2 1,2,4-triazine-4-amine derivatives ADORA2B, ADORA2A, ADORA1 ALDH1A1 763/4885GAA 4717/4885SMN1; SMN2 3837/4885
US-12054472-B2 1,2,4-triazine-4-amine derivatives ADORA2A, ADORA2B, ADORA1 ALDH1A1 251/4885GAA 2949/4885SMN1; SMN2 1567/4885
US-20170291888-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES PTGER1, LTB4R2, LTB4R ALDH1A1 1211/4885GAA 4709/4885SMN1; SMN2 3621/4885
US-20130029963-A1 1,2,4-TRIAZINE-4-AMINE DERIVATIVES ADORA2B, ADORA2A, ADORA1 ALDH1A1 784/4885GAA 4717/4885SMN1; SMN2 3817/4885

“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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