SCHEMBL14024765

SCHEMBL14024765

Cc1cc2cc(Nc3ccnc(NC4CCCCC4)n3)ccc2[nH]1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 2/20 0.57
▸ WEE1 P30291 1/20 0.52
▸ MAOA P21397 1/20 0.47
▸ MAOB P27338 1/20 0.47
▸ SYK P43405 1/20 0.47
▸ MAPK8 P45983 1/20 0.46
▸ EIF2AK2 P19525 2/20 0.45
▸ ROCK2 O75116 1/20 0.45
▸ AURKB Q96GD4 2/20 0.43
▸ KDR P35968 1/20 0.43
▸ CDK1 P06493 2/20 0.43
▸ CDK4 P11802 2/20 0.43
▸ CCNB1 P14635 2/20 0.43
▸ CCNA2 P20248 2/20 0.43
▸ CCND1 P24385 2/20 0.43
▸ CDK2 P24941 2/20 0.43
▸ CCNA1 P78396 2/20 0.43
▸ GALR2 O43603 1/20 0.43
▸ GALR1 P47211 1/20 0.43
▸ PAK4 O96013 1/20 0.43

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
SCHEMBL14024764 0.94 CDC7 (0.49) CDC7WEE1MAOAMAOBSYK
SCHEMBL849257 0.84 SYK (0.62) SYKROCK2KDRCDK1AURKA
SCHEMBL3459130 0.78 AURKA (0.61) SYKROCK2AURKBKDRCDK1
SCHEMBL4875518 0.78 SYK (0.56) SYKROCK2KDRCDK1ALDH1A1
SCHEMBL14024356 0.77 KDR (0.66) SYKEIF2AK2ROCK2AURKBKDR
SCHEMBL14024743 0.77 AURKA (0.64) SYKMAPK8ROCK2AURKBKDR
SCHEMBL4882766 0.77 KDR (0.66) CDC7SYKEIF2AK2ROCK2KDR
SCHEMBL14850419 0.76 SYK (0.49) SYKROCK2KDRKDM4EALDH1A1
SCHEMBL4879556 0.76 SYK (0.54) SYKMAPK8EIF2AK2ROCK2AURKB
SCHEMBL4875560 0.76 KDR (0.69) SYKEIF2AK2KDRCDK4CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2154967-B9 PYRIMIDINE DERIVATIVES HUTCHISON MEDIPHARMA ENTPR LTD (BS) 2014-07-23 — — EP claimed
EP-2154967-B1 PYRIMIDINE DERIVATIVES HUTCHISON MEDIPHARMA ENTPR LTD (BS) 2014-03-05 — — EP claimed
US-8901143-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2014-12-02 — — US disclosed
US-8901143-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2014-12-02 — — US disclosed
EP-2154967-B9 PYRIMIDINE DERIVATIVES HUTCHISON MEDIPHARMA ENTPR LTD (BS) 2014-07-23 — — EP disclosed
EP-2154967-B1 PYRIMIDINE DERIVATIVES HUTCHISON MEDIPHARMA ENTPR LTD (BS) 2014-03-05 — — EP disclosed
US-20130065890-A1 PYRIMIDINE DERIVATIVES HUTCHISON MEDIPHARMA ENTERPRISES LIMITED 2013-03-14 — — US disclosed
US-20130065890-A1 PYRIMIDINE DERIVATIVES HUTCHISON MEDIPHARMA ENTERPRISES LIMITED 2013-03-14 — — US disclosed
US-8349859-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2013-01-08 — — US disclosed
US-8349859-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2013-01-08 — — US disclosed
US-20080255172-A1 N4-(2-methyl-1H-indol-5-yl)-N2-phenylpyrimidine-2,4-diamine; angiogenesis related disorder like cancer or age-related macular degeneration HUTCHISON MEDIPHARMA ENTERPRISES LIMETED (BS) 2008-10-16 — — US disclosed
US-20080255172-A1 N4-(2-methyl-1H-indol-5-yl)-N2-phenylpyrimidine-2,4-diamine; angiogenesis related disorder like cancer or age-related macular degeneration HUTCHISON MEDIPHARMA ENTERPRISES LIMETED (BS) 2008-10-16 — — 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 (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-20080255172-A1 N4-(2-methyl-1H-indol-5-yl)-N2-phenylpyrimidine-2,4-diamine; angiogenesis related disorder like cancer or age-related macular degeneration CCND2, KDR, FLT4 CDC7 2398/4885WEE1 685/4885MAOA 881/4885
US-20130065890-A1 PYRIMIDINE DERIVATIVES TYMS, KDR, FLT4 CDC7 1748/4885WEE1 637/4885MAOA 1392/4885

“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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