SCHEMBL2067918

SCHEMBL2067918

Cc1ccnc(Nc2ncc(Sc3ccnc(C(=O)NCC(c4ccccc4)c4ccccc4C)c3F)s2)c1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 13/20 0.42
▸ KDR P35968 1/20 0.41
▸ LCK P06239 1/20 0.40
▸ JAK3 P52333 3/20 0.38
▸ BTK Q06187 2/20 0.38
▸ NR3C2 P08235 1/20 0.37
▸ TXK P42681 1/20 0.37
▸ CTSA P10619 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
SCHEMBL2065656 0.94 KDR (0.45) NTRK1KDRLCKJAK3BTK
SCHEMBL2065982 0.93 KDR (0.40) NTRK1KDRLCKJAK3BTK
SCHEMBL2065114 0.92 NTRK1 (0.40) NTRK1KDRLCKJAK3BTK
SCHEMBL2067768 0.90 NTRK1 (0.43) NTRK1KDRLCKJAK3BTK
SCHEMBL10193864 0.89 NTRK1 (0.41) NTRK1KDRLCKJAK3BTK
Hydrochloric Acid SCHEMBL2067915 0.88 NTRK1 (0.41) NTRK1KDRLCKJAK3BTK
SCHEMBL2066496 0.88 KDR (0.42) NTRK1KDRLCK
SCHEMBL10193829 0.88 KDR (0.42) NTRK1KDRLCK
SCHEMBL2066327 0.88 NTRK1 (0.36) NTRK1KDRLCKJAK3BTK
SCHEMBL10193870 0.88 KDR (0.41) NTRK1KDRLCKJAK3BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2099794-B1 THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2013-05-15 — — EP disclosed
EP-2099794-B1 THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2013-05-15 — — EP disclosed
US-8148400-B2 Thiazolyl compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-03 — — US disclosed
US-8148400-B2 Thiazolyl compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-03 — — US disclosed
US-8148400-B2 Thiazolyl compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-03 — — US disclosed
US-20100048581-A1 THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-25 — — US disclosed
US-20100048581-A1 THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-25 — — US disclosed
US-20100048581-A1 THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-25 — — US disclosed
WO-2008079873-A2 THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-07-03 — — 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 (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-20100048581-A1 THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS ERBB2, TEC, TTBK1 NTRK1 327/4885KDR 672/4885LCK 16/4885

“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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