SCHEMBL1640751

SCHEMBL1640751

CN(C(=O)C1CCCCC1)c1cccc(-c2nc(N)sc2-c2ccnc(=O)[nH]2)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.35
▸ ITK Q08881 8/20 0.34
▸ TEC P42680 1/20 0.34
▸ TXK P42681 1/20 0.34
▸ NR1H4 Q96RI1 2/20 0.34
▸ GHSR Q92847 1/20 0.33
▸ TGFBR1 P36897 1/20 0.33
▸ INSR P06213 7/20 0.33
▸ S1PR1 P21453 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL1641859 0.83 TGFBR1 (0.40) MAPK14ITKNR1H4GHSRTGFBR1
SCHEMBL1640332 0.74 AURKA (0.42) —
SCHEMBL1640584 0.71 EGFR (0.44) —
SCHEMBL1641756 0.71 EGFR (0.42) INSR
SCHEMBL1641842 0.69 BRAF (0.45) —
SCHEMBL9001804 0.68 HSD17B1 (0.49) KDM4EITKNR1H4INSRSMN1; SMN2
SCHEMBL1034632 0.65 HDAC8 (0.51) ITKINSRMAPK1
SCHEMBL1640122 0.63 TGFBR1 (0.41) TGFBR1
SCHEMBL12726495 0.63 ABL1 (0.50) MAPK14TGFBR1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL6387484 0.63 HSD17B1 (0.44) KDM4EITKTECTXKNR1H4

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 MAPK14 312/4885KDM4E 1783/4885ITK 193/4885

“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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