SCHEMBL17404673

SCHEMBL17404673

CCc1cccc(-n2nccc2-c2cc(N)ncc2-c2ccc(N3CCN(C)CC3)cc2OC)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 4/20 0.60
▸ AGXT P21549 1/20 0.39
▸ MAP4K1 Q92918 2/20 0.37
▸ HTR6 P50406 2/20 0.36
▸ RPS6KA3 P51812 1/20 0.36
▸ LCK P06239 2/20 0.36
▸ KDR P35968 2/20 0.36
▸ FYN P06241 3/20 0.36
▸ HCK P08631 1/20 0.35
▸ SRC P12931 1/20 0.35
▸ INSR P06213 1/20 0.35
▸ NPM1 P06748 1/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ EGFR P00533 2/20 0.35
▸ KHK P50053 1/20 0.35

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
SCHEMBL15933046 0.93 ALK (0.59) ALKAGXTMAP4K1HTR6RPS6KA3
SCHEMBL17404654 0.88 ALK (0.69) ALKMAP4K1RPS6KA3FYN
SCHEMBL15933060 0.87 ALK (0.55) ALKLCKKDREGFR
SCHEMBL15932988 0.86 ALK (0.62) ALKMAP4K1RPS6KA3LCKKDR
SCHEMBL17404663 0.85 ALK (0.59) ALKMAP4K1RPS6KA3LCKKDR
SCHEMBL17404662 0.85 ALK (0.59) ALKMAP4K1RPS6KA3LCKKDR
SCHEMBL15933047 0.85 ALK (0.59) ALKMAP4K1RPS6KA3LCKKDR
SCHEMBL15933045 0.82 ALK (0.64) ALKMAP4K1RPS6KA3FYNINSR
SCHEMBL17404661 0.80 ALK (0.77) ALKKHK
SCHEMBL15933034 0.79 ALK (0.84) ALKFYN

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 2 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-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 853/4885AGXT 3827/4885MAP4K1 33/4885

“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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