SCHEMBL30830461

SCHEMBL30830461

Cc1cc(I)cc(C)c1NC(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LCK P06239 13/20 0.48
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA9 Q16790 1/20 0.42
ATR Q13535 1/20 0.40
NLRP3 Q96P20 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
SCHEMBL3131919 0.86 LCK (0.60) LCKCA12CA1CA9NLRP3
SCHEMBL20865564 0.86 LCK (0.50) LCKCA12CA1CA9ATR
SCHEMBL17528556 0.84 LCK (0.49) LCKCA12CA1CA9ATR
SCHEMBL25243093 0.83 LCK (0.62) LCKCA12CA1CA9
SCHEMBL17528554 0.81 LCK (0.50) LCKCA12CA1CA9ATR
SCHEMBL30830459 0.81 LCK (0.47) LCKCA12CA1CA9ATR
SCHEMBL557858 0.79 SMN1; SMN2 (0.46) CA12CA1CA9
SCHEMBL24233914 0.79 LCK (0.46) LCKCA12CA1CA9ATR
SCHEMBL1689760 0.79 CA12 (0.43) CA12CA1CA9ATR
SCHEMBL24574915 0.79 LCK (0.60) LCKATRNLRP3

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
EP-4582428-A1 PYRAZOLOPYRIMIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF Japan Tobacco Inc. (JP) 2025-07-09 EP disclosed
US-20250114361-A1 PYRAZOLOPYRIMIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2025-04-10 US disclosed
CN-119790055-A Pyrazolopyrimidine compound and medical use thereof 日本烟草产业株式会社 2025-04-08 CN disclosed
WO-2024048519-A1 PYRAZOLOPYRIMIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF 日本たばこ産業株式会社 2024-03-07 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-20250114361-A1 PYRAZOLOPYRIMIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF NLRP3, NLRP1, PYCARD LCK 1258/4885CA12 4579/4885CA1 4550/4885

“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.