SCHEMBL24577720

SCHEMBL24577720

Cc1ncc(NC(=O)C[C@H]2CCN(C(C)C)C2)cc1NC(=O)c1cnn2cc(-c3cnn(C)c3)sc12

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 12/20 0.38
▸ DYRK1A Q13627 12/20 0.38
▸ CSF1R P07333 1/20 0.37
▸ KIT P10721 1/20 0.37
▸ CHRM1 P11229 1/20 0.36
▸ PDGFRA P16234 1/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.36
▸ WNT1 P04628 5/20 0.34
▸ NAMPT P43490 1/20 0.33
▸ USP30 Q70CQ3 3/20 0.33
▸ RET P07949 2/20 0.33
▸ CLK2 P49760 1/20 0.32
▸ CLK3 P49761 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
SCHEMBL29760106 1.00 GSK3B (0.38) GSK3BDYRK1ACSF1RKITCHRM1
SCHEMBL29759770 1.00 GSK3B (0.38) GSK3BDYRK1ACSF1RKITCHRM1
SCHEMBL30566605 1.00 GSK3B (0.38) GSK3BDYRK1ACSF1RKITCHRM1
SCHEMBL24577577 1.00 GSK3B (0.38) GSK3BDYRK1ACSF1RKITCHRM1
SCHEMBL27185042 1.00 GSK3B (0.38) GSK3BDYRK1ACSF1RKITCHRM1
SCHEMBL24577578 0.91 IKBKE (0.36) GSK3BDYRK1ACSF1RKITCHRM1
SCHEMBL24577470 0.91 IKBKE (0.36) GSK3BDYRK1ACSF1RKITCHRM1
SCHEMBL29759795 0.91 IKBKE (0.36) GSK3BDYRK1ACSF1RKITCHRM1
SCHEMBL30566543 0.91 IKBKE (0.36) GSK3BDYRK1ACSF1RKITCHRM1
SCHEMBL29759475 0.91 IKBKE (0.36) GSK3BDYRK1ACSF1RKITCHRM1

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-20240109917-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2024-04-04 — — US disclosed
WO-2022136509-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2022-06-30 — — 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-20240109917-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS PDGFRA, PDGFRB, ABL1 GSK3B 1914/4885DYRK1A 1429/4885CSF1R 173/4885

“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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