SCHEMBL1642004

SCHEMBL1642004

CN(C(=O)c1cc(F)ccc1F)c1cccc(C(=O)Cc2ccnc(Nc3cccc(-c4cnco4)c3)n2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 4/20 0.40
▸ PDGFRB P09619 2/20 0.40
▸ HDAC3 O15379 1/20 0.40
▸ KDR P35968 1/20 0.40
▸ HDAC4 P56524 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC7 Q8WUI4 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ HDAC10 Q969S8 1/20 0.40
▸ HDAC11 Q96DB2 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ HDAC9 Q9UKV0 1/20 0.40
▸ HDAC5 Q9UQL6 1/20 0.40
▸ SYK P43405 4/20 0.39
▸ MAP3K7 O43318 1/20 0.39
▸ IRAK4 Q9NWZ3 1/20 0.39
▸ PRKCQ Q04759 1/20 0.38
▸ BCR P11274 3/20 0.36
▸ BRAF P15056 1/20 0.36

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
SCHEMBL12726473 0.86 ABL1 (0.46) ABL1PDGFRBSYKMAP3K7IRAK4
SCHEMBL1641187 0.79 ABL1 (0.43) ABL1PDGFRBHDAC3KDRHDAC4
SCHEMBL1641700 0.78 CDC7 (0.39) ABL1PDGFRBHDAC3KDRHDAC4
SCHEMBL1640335 0.77 KDR (0.40) KDRSYKEGFRCDC7CDK19
SCHEMBL1640564 0.75 TYRO3 (0.46) BRAF
SCHEMBL1640323 0.68 KDR (0.48) ABL1PDGFRBKDRBCRPDGFRA
SCHEMBL12766477 0.67 KDR (0.42) ABL1KDRBCREGFRCDC7
SCHEMBL12726468 0.67 ABL1 (0.47) ABL1PDGFRBSYKMAP3K7IRAK4
SCHEMBL12766402 0.67 CCNT1 (0.44) ABL1PDGFRBKDRBCRPDGFRA
SCHEMBL12726478 0.67 KDR (0.47) ABL1KDRBCREGFRCDC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 — — 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-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors PDXK, MAP3K1, MAP4K2 ABL1 77/4885PDGFRB 636/4885HDAC3 727/4885

“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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