SCHEMBL30913245

SCHEMBL30913245

COC(C)(C)CNc1nncc2ccncc12

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 4/20 0.38
LATS2 Q9NRM7 2/20 0.38
PRKCH P24723 5/20 0.36
PRKCQ Q04759 5/20 0.36
PRKCE Q02156 4/20 0.36
PRKCD Q05655 4/20 0.36
ROCK2 O75116 2/20 0.36
ROCK1 Q13464 2/20 0.36
PKN1 Q16512 2/20 0.36
PKN2 Q16513 2/20 0.36
PRKCB P05771 2/20 0.36
PRKCA P17252 1/20 0.36
TTK P33981 11/20 0.35
MAOA P21397 1/20 0.33

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
SCHEMBL30913251 0.92 PRKCH (0.37) LATS1LATS2PRKCHPRKCQPRKCE
SCHEMBL30913262 0.84 LATS1 (0.38) LATS1LATS2PRKCHPRKCQPRKCE
SCHEMBL24379645 0.78 PRKCH (0.37) LATS1LATS2PRKCHPRKCQPRKCE
SCHEMBL24379644 0.78 PRKCH (0.37) LATS1LATS2PRKCHPRKCQPRKCE
SCHEMBL30913253 0.77 LATS1 (0.34) LATS1LATS2PRKCHPRKCQPRKCE
SCHEMBL25857289 0.74 LATS1 (0.41) LATS1LATS2MAOA
SCHEMBL29560059 0.71 KDR (0.39) PRKCHPRKCQPRKCEPRKCD
SCHEMBL24379571 0.70 KDR (0.37) PRKCHPRKCQPRKCEPRKCDROCK2
SCHEMBL32660756 0.70 KDR (0.37) PRKCHPRKCQPRKCEPRKCDROCK2
SCHEMBL30913247 0.69 TRPM8 (0.42) LATS1LATS2ROCK2

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-20240158396-A1 COMPOUNDS FOR INHIBITING NLRP3 AND USES THEREOF VENTUS THERAPEUTICS U S INC (US) 2024-05-16 US claimed

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-20240158396-A1 COMPOUNDS FOR INHIBITING NLRP3 AND USES THEREOF NLRP3, NLRP1, PYCARD LATS1 3683/4885LATS2 3294/4885PRKCH 1152/4885

“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.