SCHEMBL24944131

SCHEMBL24944131

CCCC(C)c1nc(C(C)(C)C)nc2sccc12

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
ELANE P08246 2/20 0.33
ADORA2A P29274 1/20 0.30
ADORA1 P30542 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
SCHEMBL24995656 0.82 ELANE (0.37) LMNAELANEADORA2AADORA1
SCHEMBL21101028 0.78 ADORA2A (0.47) ELANEADORA2AADORA1
SCHEMBL24943858 0.74 ALDH1A1 (0.41) LMNAADORA2A
SCHEMBL21341735 0.74 LMNA (0.36) LMNAELANEADORA2AADORA1
SCHEMBL19565807 0.74 CHEK1 (0.45) LMNA
SCHEMBL24175509 0.71 MAPK1 (0.38) LMNAELANEADORA2AADORA1
SCHEMBL10139174 0.71 ADORA2A (0.36) LMNAELANEADORA2AADORA1
SCHEMBL18701492 0.69 ADORA2A (0.36) LMNAELANEADORA2AADORA1
SCHEMBL20618771 0.67
SCHEMBL21101027 0.67 USP2 (0.31) LMNA

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-20230030115-A1 RHO-ASSOCIATED PROTEIN KINASE INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD AND USE THEREOF BEIJING TIDE PHARMACEUTICAL CO LTD (CN) 2023-02-02 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-20230030115-A1 RHO-ASSOCIATED PROTEIN KINASE INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD AND USE THEREOF ROCK1, ROCK2, RHOA LMNA 1748/4885ELANE 3101/4885ADORA2A 3184/4885

“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.