SCHEMBL25295337

SCHEMBL25295337

C#Cc1ccc(-c2nnc(N[C@@H]3CCCNC3)nc2N(C)C)c(O)c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CDK7 P50613 8/20 0.39
CCNH P51946 8/20 0.39
MNAT1 P51948 7/20 0.39
CCNK O75909 7/20 0.39
CDK12 Q9NYV4 7/20 0.39
CCNT1 O60563 6/20 0.39
CDK9 P50750 6/20 0.39
CCNE1 P24864 5/20 0.39
CDK2 P24941 5/20 0.39
CHEK2 O96017 3/20 0.38
NLRP3 Q96P20 3/20 0.35
IL1B P01584 2/20 0.35
PRKCZ Q05513 1/20 0.35
PRKD2 Q9BZL6 1/20 0.35

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
SCHEMBL30488577 1.00 CDK7 (0.39) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL25295338 1.00 CDK7 (0.39) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL30488470 0.88 CDK7 (0.41) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL25302533 0.88 CDK7 (0.41) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL25302529 0.88 CDK7 (0.41) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL30488571 0.85 CDK7 (0.41) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL25300774 0.85 CDK7 (0.41) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL25300773 0.85 CDK7 (0.41) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL31197254 0.84 CCNK (0.38) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL30488539 0.83 IL1B (0.47) NLRP3IL1B

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
US-20250152584-A1 NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2025-05-15 US disclosed
EP-4461729-A1 ANTIGEN BINDING PROTEIN TARGETING MSLN AND USE THEREOF Transthera Sciences (Nanjing), Inc. (CN) 2024-11-13 EP disclosed
WO-2023131277-A1 NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF 药捷安康(南京)科技股份有限公司 2023-07-13 WO disclosed
CN-116410140-A NLRP3 inflammation corpuscle inhibitor and application thereof 药捷安康(南京)科技股份有限公司 2023-07-11 CN 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-20250152584-A1 NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF NLRP3, NLRP1, PYCARD CDK7 3675/4885CCNH 4833/4885MNAT1 1199/4885

“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.