SCHEMBL6107613

SCHEMBL6107613

NC(=O)c1cccc(-c2nn3c(NC4CCCC4)cccc3c2-c2ccnc(NC3CCCC3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.47
MAPK10 P53779 1/20 0.41
CDK4 P11802 2/20 0.41
MAPK8 P45983 8/20 0.40
MAPK9 P45984 6/20 0.40
PRKD1 Q15139 3/20 0.40
PRKD2 Q9BZL6 3/20 0.40
AURKA O14965 1/20 0.40
TTK P33981 1/20 0.40
AURKB Q96GD4 1/20 0.40
INCENP Q9NQS7 1/20 0.40
ADRB1 P08588 1/20 0.40
DGAT1 O75907 1/20 0.40
KDR P35968 1/20 0.39
ROCK2 O75116 1/20 0.39
CCNB2 O95067 1/20 0.39
CDK1 P06493 1/20 0.39
CCNB1 P14635 1/20 0.39
CCNB3 Q8WWL7 1/20 0.39
PIK3CG P48736 1/20 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
SCHEMBL6107637 0.93 MAPK10 (0.43) MAPK14MAPK10CDK4MAPK8MAPK9
SCHEMBL6104157 0.87 CDK4 (0.43) MAPK14MAPK10CDK4MAPK8MAPK9
SCHEMBL6104241 0.87 CDK4 (0.43) MAPK10CDK4MAPK8MAPK9AURKA
SCHEMBL6105760 0.87 MAPK10 (0.49) MAPK14MAPK10CDK4MAPK8MAPK9
SCHEMBL6105435 0.87 MAPK10 (0.52) MAPK14MAPK10CDK4MAPK8MAPK9
SCHEMBL6106982 0.85 TP53 (0.46) MAPK10CDK4MAPK8MAPK9KDR
SCHEMBL6107098 0.85 CDK4 (0.50) MAPK14MAPK10CDK4MAPK8KDR
SCHEMBL6106438 0.85 ADORA1 (0.48) MAPK10CDK4MAPK8MAPK9DGAT1
SCHEMBL6106593 0.85 TP53 (0.46) MAPK14MAPK10CDK4MAPK8MAPK9
SCHEMBL6105643 0.85 CDK4 (0.43) MAPK14MAPK10CDK4MAPK8MAPK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7153855-B2 Pyrazolopyridinyl pyrimidine therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-12-26 US claimed
US-20050049260-A1 Therapeutic compounds SMITHKLINE BEECHAM CORPORATION 2005-03-03 US claimed
US-7153855-B2 Pyrazolopyridinyl pyrimidine therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-12-26 US disclosed
US-20050049260-A1 Therapeutic compounds SMITHKLINE BEECHAM CORPORATION 2005-03-03 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-20050049260-A1 Therapeutic compounds ABCB1, PCSK9, ABCB11 MAPK14 4328/4885MAPK10 2227/4885CDK4 2304/4885

“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.