SCHEMBL30706331

SCHEMBL30706331

CC1(C)c2[nH]ncc2CN1C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.45
CCNA2 P20248 8/20 0.32
CDK2 P24941 8/20 0.32
CCNA1 P78396 8/20 0.32
PDPK1 O15530 1/20 0.32
PDK2 Q15119 2/20 0.30
CCNC P24863 1/20 0.30
CDK8 P49336 1/20 0.30
CDK19 Q9BWU1 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
SCHEMBL15252624 0.86 NR1H2 (0.46) NR1H2CCNA2CDK2CCNA1PDK2
SCHEMBL30706326 0.71 CYP1A2 (0.46)
SCHEMBL30706322 0.71 NR1H2 (0.35) NR1H2CCNA2CDK2CCNA1
SCHEMBL30706325 0.71 CYP1A2 (0.46)
SCHEMBL30706332 0.70 KDM4E (0.41) CCNA2CDK2CCNA1
SCHEMBL30706324 0.70 NR1H2 (0.34) NR1H2CCNA2CDK2CCNA1
SCHEMBL30706328 0.70 LCK (0.38) PDK2
SCHEMBL30706327 0.70 LCK (0.38) PDK2
SCHEMBL30706321 0.69 DGAT1 (0.38) NR1H2CCNA2CDK2CCNA1
SCHEMBL29573372 0.64 NAMPT (0.40) NR1H2CCNA2CDK2CCNA1PDPK1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12304913-B2 Dihydropyrrolopyrazole derivative UBE INDUSTRIES, LTD. (JP) 2025-05-20 US claimed
EP-3885347-B1 DIHYDROPYRROLOPYRAZOLE DERIVATIVE UBE CORP (JP) 2023-11-22 EP claimed
US-12304913-B2 Dihydropyrrolopyrazole derivative UBE INDUSTRIES, LTD. (JP) 2025-05-20 US disclosed
CN-114174281-B Degradation agent for cyclin-dependent kinase 7 (CDK 7) and use thereof 达纳-法伯癌症研究公司 2025-02-07 CN disclosed
US-12168663-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-12-17 US disclosed
EP-3885347-B1 DIHYDROPYRROLOPYRAZOLE DERIVATIVE UBE CORP (JP) 2023-11-22 EP 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 (2 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-12168663-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) CDK7, CDK3, CDK9 NR1H2 2934/4885CCNA2 41/4885CDK2 7/4885
US-12304913-B2 Dihydropyrrolopyrazole derivative CBR3, SLC13A3, CYP3A5 NR1H2 1341/4885CCNA2 2036/4885CDK2 1654/4885

“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.