SCHEMBL29760054

SCHEMBL29760054

Cc1ncc(C(=O)NCCN2CC3CCC2CC3)cc1NC(=O)c1cnn2cc(-c3cnn4c3CCC4)sc12

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 2/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.41
▸ POLQ O75417 1/20 0.36
▸ KIT P10721 2/20 0.33
▸ HSD17B13 Q7Z5P4 1/20 0.33
▸ CDK9 P50750 2/20 0.30
▸ CCNT1 O60563 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL24578004 1.00 PDGFRA (0.41) PDGFRACHRM1HRH3POLQKIT
SCHEMBL30897456 0.91 PDGFRA (0.39) PDGFRACHRM1HRH3POLQCDK9
SCHEMBL24577454 0.91 PDGFRA (0.39) PDGFRACHRM1HRH3POLQCDK9
SCHEMBL30809553 0.90 PDGFRA (0.43) PDGFRACHRM1HRH3POLQKIT
SCHEMBL29759658 0.90 PDGFRA (0.42) PDGFRACHRM1HRH3POLQCDK9
SCHEMBL24578272 0.90 PDGFRA (0.42) PDGFRACHRM1HRH3POLQCDK9
SCHEMBL30809496 0.89 PDGFRA (0.42) PDGFRACHRM1HRH3POLQKIT
SCHEMBL30809525 0.89 PDGFRA (0.41) PDGFRACHRM1HRH3POLQKIT
SCHEMBL30809490 0.88 PDGFRA (0.44) PDGFRACHRM1HRH3POLQKIT
SCHEMBL30809528 0.88 PDGFRA (0.41) PDGFRACHRM1HRH3POLQKIT

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 3 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
EP-4267585-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS Actelion Pharmaceuticals Ltd (CH) 2023-11-01 — — EP 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 PDGFRA 1/4885CHRM1 4399/4885HRH3 1593/4885

“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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