SCHEMBL16610263

SCHEMBL16610263

Cc1cnc(N)nc1-n1ccc2cnc(Br)cc21

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 6/20 0.41
▸ CDK2 P24941 5/20 0.41
▸ TTBK1 Q5TCY1 6/20 0.41
▸ MAP3K14 Q99558 3/20 0.39
▸ RPS6KA5 O75582 1/20 0.38
▸ ROCK1 Q13464 4/20 0.36
▸ FGFR1 P11362 1/20 0.35
▸ LCK P06239 1/20 0.35
▸ KIT P10721 1/20 0.35
▸ SRC P12931 1/20 0.35
▸ TTBK2 Q6IQ55 3/20 0.34
▸ NUDT1 P36639 1/20 0.34

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
SCHEMBL16610267 0.84 CDC7 (0.41) CDC7CDK2TTBK1MAP3K14RPS6KA5
SCHEMBL16610255 0.84 CDC7 (0.47) CDC7CDK2TTBK1MAP3K14RPS6KA5
SCHEMBL18585632 0.77 CDC7 (0.54) CDC7CDK2RPS6KA5ROCK1LCK
SCHEMBL16610272 0.75 CDC7 (0.71) CDC7CDK2TTBK1MAP3K14ROCK1
SCHEMBL20476705 0.68 PIK3CB (0.49) —
SCHEMBL30219552 0.65 MAPKAPK2 (0.56) MAP3K14LCKKITSRC
SCHEMBL28986302 0.65 MAP3K14 (0.49) CDC7CDK2MAP3K14ROCK1FGFR1
SCHEMBL28986271 0.65 MAP3K14 (0.50) CDC7CDK2MAP3K14ROCK1FGFR1
SCHEMBL30219561 0.65 MAP3K14 (0.50) CDC7CDK2MAP3K14ROCK1FGFR1
SCHEMBL28986278 0.65 MAPKAPK2 (0.56) MAP3K14LCKKITSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3071566-B1 NEW 1-(4-PYRIMIDINYL)-1H-PYRROLO[3,2-C]PYRIDINE DERIVATIVES AS NIK INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2020-04-15 — — EP disclosed
US-10005773-B2 1-(4-pyrimidinyl)-1H-pyrrolo[3,2-c]pyridine derivatives as NIK inhibitors JANSSEN PHARMACEUTICA NV (BE) 2018-06-26 — — US disclosed
US-10005773-B2 1-(4-pyrimidinyl)-1H-pyrrolo[3,2-c]pyridine derivatives as NIK inhibitors JANSSEN PHARMACEUTICA NV (BE) 2018-06-26 — — US disclosed
US-20160257679-A1 NEW 1-(4-PYRIMIDINYL)-1H-PYRROLO[3,2-c]PYRIDINE DERIVATIVES AS NIK INHIBITORS ARGENTA DISCOVERY 2009 LIMITED (GB) 2016-09-08 — — US disclosed
US-20160257679-A1 NEW 1-(4-PYRIMIDINYL)-1H-PYRROLO[3,2-c]PYRIDINE DERIVATIVES AS NIK INHIBITORS ARGENTA DISCOVERY 2009 LIMITED (GB) 2016-09-08 — — US disclosed
WO-2015044267-A1 NEW 1-(4-PYRIMIDINYL)-1H-PYRROLO[3,2-c]PYRIDINE DERIVATIVES AS NIK INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2015-04-02 — — 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 (2 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-10005773-B2 1-(4-pyrimidinyl)-1H-pyrrolo[3,2-c]pyridine derivatives as NIK inhibitors MAP3K14, MAP3K15, MAP3K12 CDC7 620/4885CDK2 784/4885TTBK1 578/4885
US-20160257679-A1 NEW 1-(4-PYRIMIDINYL)-1H-PYRROLO[3,2-c]PYRIDINE DERIVATIVES AS NIK INHIBITORS MAP3K14, MAP3K15, MAP3K12 CDC7 548/4885CDK2 673/4885TTBK1 558/4885

“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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