SCHEMBL27184980

SCHEMBL27184980

Cc1ncc(NC(=O)O)cc1NC(=O)c1cnn2cc(-c3cnn4c3COCC4)sc12

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 1/20 0.35
▸ CDK9 P50750 1/20 0.35
▸ POLQ O75417 2/20 0.34
▸ IRAK4 Q9NWZ3 11/20 0.34
▸ RAF1 P04049 5/20 0.34
▸ BRAF P15056 5/20 0.34
▸ IRAK1 P51617 1/20 0.32
▸ PDGFRA P16234 1/20 0.31

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
SCHEMBL24577427 0.94 IRAK4 (0.38) CCNT1CDK9POLQIRAK4RAF1
SCHEMBL29759708 0.92 CCNT1 (0.35) CCNT1CDK9POLQIRAK4RAF1
SCHEMBL24579079 0.92 CCNT1 (0.35) CCNT1CDK9POLQIRAK4RAF1
SCHEMBL29759922 0.90 CCNT1 (0.35) CCNT1CDK9POLQIRAK4IRAK1
SCHEMBL24579066 0.90 CCNT1 (0.35) CCNT1CDK9POLQIRAK4IRAK1
SCHEMBL24577464 0.90 WNT3A (0.34) CCNT1CDK9POLQIRAK4RAF1
SCHEMBL24577845 0.90 POLQ (0.33) CCNT1CDK9POLQIRAK4RAF1
SCHEMBL24578250 0.90 WNT3A (0.34) CCNT1CDK9POLQIRAK4RAF1
SCHEMBL24577437 0.89 CCNT1 (0.36) CCNT1CDK9POLQIRAK4RAF1
SCHEMBL29759926 0.89 CCNT1 (0.36) CCNT1CDK9POLQIRAK4RAF1

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 1 patent. 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

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 CCNT1 1550/4885CDK9 269/4885POLQ 2881/4885

“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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