SCHEMBL17404669

SCHEMBL17404669

COc1cc(N2CCNCC2)ccc1-c1cnc(N)cc1Nc1ccccc1S(=O)(=O)NC(C)C

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 8/20 0.52
▸ ZAP70 P43403 5/20 0.46
▸ IGF1R P08069 1/20 0.45
▸ PTK2 Q05397 1/20 0.45
▸ PTK2B Q14289 1/20 0.45
▸ EGFR P00533 4/20 0.44
▸ RIPK2 O43353 1/20 0.40
▸ ACVR1 Q04771 1/20 0.40
▸ NOD2 Q9HC29 1/20 0.40
▸ DCLK1 O15075 1/20 0.40
▸ MAPK7 Q13164 1/20 0.40
▸ LRRK2 Q5S007 1/20 0.40
▸ ULK1 O75385 1/20 0.40

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
Hydrochloric Acid SCHEMBL17310002 0.99 ALK (0.51) ALKZAP70IGF1RPTK2PTK2B
SCHEMBL17310205 0.86 ALK (0.44) ALKZAP70IGF1RPTK2PTK2B
Hydrochloric Acid SCHEMBL28036122 0.86 ALK (0.47) ALKEGFRRIPK2ACVR1NOD2
SCHEMBL17310174 0.79 ALK (0.51) ALKRIPK2ACVR1NOD2
SCHEMBL17310247 0.73 ZAP70 (0.46) ALKZAP70IGF1RPTK2PTK2B
SCHEMBL12887709 0.72 MAPK10 (0.58) ALKZAP70IGF1RPTK2PTK2B
SCHEMBL17310097 0.70 ZAP70 (0.39) ZAP70EGFRULK1
SCHEMBL1232263 0.69 MAPK10 (0.68) ALKZAP70PTK2LRRK2ULK1
SCHEMBL3303507 0.69 ALK (0.66) ALKZAP70IGF1RPTK2PTK2B
SCHEMBL2821418 0.68 ALK (1.00) ALKZAP70IGF1RPTK2PTK2B

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-9708295-B2 Substituted 2-aminopyridine protein kinase inhibitor CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2017-07-18 — — US disclosed
US-9708295-B2 Substituted 2-aminopyridine protein kinase inhibitor CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2017-07-18 — — US disclosed
US-20160002205-A1 SUBSTITUTED 2-AMINOPYRIDINE PROTEIN KINASE INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD (CN) 2016-01-07 — — US disclosed
US-20160002205-A1 SUBSTITUTED 2-AMINOPYRIDINE PROTEIN KINASE INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD (CN) 2016-01-07 — — 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-20160002205-A1 SUBSTITUTED 2-AMINOPYRIDINE PROTEIN KINASE INHIBITOR PACSIN2, MAPKAPK2, PRKCA ALK 853/4885ZAP70 460/4885IGF1R 3302/4885

“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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