SCHEMBL4753013

SCHEMBL4753013

Cc1cnc(Cl)nc1-c1ccnc(F)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ADORA2B P29275 7/20 0.43
▸ ADORA2A P29274 3/20 0.43
▸ NQO2 P16083 2/20 0.41
▸ IDO1 P14902 1/20 0.41
▸ MAP4K4 O95819 1/20 0.40
▸ MINK1 Q8N4C8 1/20 0.40
▸ TNIK Q9UKE5 1/20 0.40
▸ SYK P43405 1/20 0.40
▸ MAPK1 P28482 2/20 0.39
▸ MAPK14 Q16539 3/20 0.39
▸ MAPK13 O15264 1/20 0.39
▸ MAPK12 P53778 1/20 0.39
▸ MAPK11 Q15759 1/20 0.39
▸ PDK1 Q15118 3/20 0.39
▸ PDK2 Q15119 2/20 0.39
▸ PDK3 Q15120 2/20 0.39
▸ PDK4 Q16654 2/20 0.39

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
SCHEMBL12465997 0.83 ADORA2B (0.48) ADORA2BADORA2ANQO2IDO1MAP4K4
SCHEMBL15229110 0.83 ADORA2B (0.44) ADORA2BADORA2ANQO2IDO1MAP4K4
SCHEMBL13829027 0.80 MAPK14 (0.40) ADORA2AMAPK14MAPK13MAPK12MAPK11
SCHEMBL12813119 0.79 AXL (0.49) ADORA2AMAPK1PDK1PDK2PDK3
SCHEMBL12813116 0.78 MAPK14 (0.42) ADORA2BADORA2AMAPK14MAPK13MAPK12
SCHEMBL22529589 0.77 PDK1 (0.50) PDK1PDK2PDK3PDK4
SCHEMBL12813257 0.75 AXL (0.47) ADORA2BADORA2AIDO1PDK1PDK2
SCHEMBL4540379 0.75 ALDH1A1 (0.55) MAPK1
SCHEMBL38657064 0.75 JMJD6 (0.51) ADORA2AMAPK1
SCHEMBL25559349 0.74 MAPK1 (0.39) MAPK1PDK1PDK2PDK3PDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3321262-B1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2021-01-13 — — EP disclosed
WO-2020206588-A1 BENZETHERS AND ANILINES OF PYRAZOLYL-AMINO-PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO., LTD. (CN) 2020-10-15 — — WO disclosed
CN-106349217-B Serine/threonine kinase inhibitors 阵列生物制药公司 2020-08-28 — — CN disclosed
EP-3321262-A1 SERINE/THREONINE KINASE INHIBITORS Array Biopharma, Inc. (US) 2018-05-16 — — EP disclosed
US-20180127393-A1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2018-05-10 — — US disclosed
EP-2820009-B1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2018-01-31 — — EP disclosed
US-9708290-B2 Serine/threonine kinase inhibitors ARRAY BIOPHARMA INC. (US) 2017-07-18 — — US disclosed
US-20160122316-A1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2016-05-05 — — US disclosed
US-9259470-B2 Serine/threonine kinase inhibitors ARRAY BIOPHARMA INC. (US) 2016-02-16 — — US disclosed
EP-2820009-A1 SERINE/THREONINE KINASE INHIBITORS Array Biopharma, Inc. (US) 2015-01-07 — — EP disclosed
US-20140249127-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2014-09-04 — — US disclosed
US-8697715-B2 Serine/threonine kinase inhibitors ARRAY BIOPHARMA, INC. (US) 2014-04-15 — — US disclosed
US-20130252934-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2013-09-26 — — US disclosed
WO-2013130976-A1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2013-09-06 — — WO disclosed
WO-2008140419-A2 PYRIDYL SUBSTITUTED PYRIMIDINE DERIVATIVES S*BIO PTE LTD (SG) 2008-11-20 — — WO disclosed
WO-2008140419-A2 PYRIDYL SUBSTITUTED PYRIMIDINE DERIVATIVES S*BIO PTE LTD (SG) 2008-11-20 — — 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 (4 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-20160122316-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K11, TTBK1 ADORA2B 4549/4885ADORA2A 4431/4885NQO2 2393/4885
US-20140249127-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K11, TTBK1 ADORA2B 4549/4885ADORA2A 4431/4885NQO2 2393/4885
US-20180127393-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K11, TTBK1 ADORA2B 4549/4885ADORA2A 4431/4885NQO2 2393/4885
US-20130252934-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K11, TTBK1 ADORA2B 4549/4885ADORA2A 4431/4885NQO2 2393/4885

“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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