SCHEMBL30781441

SCHEMBL30781441

Cc1cc(Cl)cc(-c2ncnn3cc(CN4C(=O)C5C(C4=O)C5(C)C)cc23)c1CN1[C@@H](C)CN(C(=O)OC(C)(C)C)C[C@@H]1C

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ USP7 Q93009 7/20 0.34
▸ KCNH2 Q12809 3/20 0.33
▸ KIT P10721 3/20 0.31
▸ P2RX3 P56373 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
SCHEMBL30781259 0.92 TBK1 (0.32) USP7KCNH2KIT
SCHEMBL27142250 0.90 USP7 (0.36) USP7KCNH2
SCHEMBL27123023 0.89 USP7 (0.36) USP7KCNH2KIT
SCHEMBL27124040 0.87 USP7 (0.35) USP7KCNH2
SCHEMBL27120927 0.86 USP7 (0.40) USP7KCNH2KITP2RX3
SCHEMBL27127692 0.86 RORC (0.33) USP7KCNH2KIT
SCHEMBL30781199 0.84 USP7 (0.43) USP7KCNH2
SCHEMBL27121880 0.84 USP7 (0.43) USP7KCNH2
Hydrochloric Acid SCHEMBL30781332 0.84 USP7 (0.42) USP7KCNH2
Hydrochloric Acid SCHEMBL27149939 0.84 USP7 (0.42) USP7KCNH2

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-20240150362-A1 Substituted Pyrrolotriazines MOLECURE S.A. (PL) 2024-05-09 — — US disclosed
WO-2024042494-A1 SUBSTITUTED PYRROLOTRIAZINES MOLECURE SA (PL) 2024-02-29 — — 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-20240150362-A1 Substituted Pyrrolotriazines USP7, UBA7, USP5 USP7 1/4885KCNH2 4094/4885KIT 3180/4885

“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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