SCHEMBL29659499

SCHEMBL29659499

NC(=O)C=CCN1CCC(F)CC1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.35
MCHR1 Q99705 2/20 0.32
EGFR P00533 2/20 0.32
CCR3 P51677 1/20 0.32
ERBB2 P04626 1/20 0.30
ERBB4 Q15303 1/20 0.30
HRH3 Q9Y5N1 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
SCHEMBL29659494 0.89 FGFR2 (0.34) SMN1; SMN2
SCHEMBL29659728 0.89 FGFR2 (0.34) SMN1; SMN2
SCHEMBL29659607 0.89 FGFR2 (0.34) SMN1; SMN2
SCHEMBL2979548 0.83 GABRR1 (0.35) MCHR1EGFRCCR3
SCHEMBL2979545 0.83 GABRR1 (0.35) MCHR1EGFRCCR3
SCHEMBL29659664 0.82 CCNK (0.35) EGFRERBB2ERBB4
SCHEMBL4327147 0.81 SMN1; SMN2 (0.37) SMN1; SMN2HRH3
SCHEMBL29265688 0.80 L3MBTL1 (0.42) SMN1; SMN2
SCHEMBL16653865 0.80 L3MBTL1 (0.42) SMN1; SMN2
SCHEMBL23074882 0.79 KDM4E (0.52) SMN1; SMN2

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-20240277722-A1 CANCER THERAPY USING A COMBINATION OF CDK7 INHIBITOR WITH AN ANTI-CANCER AGENT AURIGENE ONCOLOGY LTD (IN) 2024-08-22 US claimed
US-20240016811-A1 CANCER THERAPY USING A COMBINATION OF CDK7 INHIBITOR WITH AN ANTI-MICROTUBULE AGENT AURIGENE ONCOLOGY LIMITED (IN) 2024-01-18 US claimed
US-12331023-B2 Substituted heterocyclyl derivatives as CDK inhibitors AURIGENE ONCOLOGY LIMITED (IN) 2025-06-17 US disclosed
US-20240277722-A1 CANCER THERAPY USING A COMBINATION OF CDK7 INHIBITOR WITH AN ANTI-CANCER AGENT AURIGENE ONCOLOGY LTD (IN) 2024-08-22 US disclosed
US-20230250062-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE ONCOLOGY LIMITED (IN) 2023-08-10 US disclosed
US-20220098156-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2022-03-31 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 (5 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-20230250062-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors CDK19, CDK9, CDK1 SMN1; SMN2 1062/4885MCHR1 3868/4885EGFR 2065/4885
US-20240277722-A1 CANCER THERAPY USING A COMBINATION OF CDK7 INHIBITOR WITH AN ANTI-CANCER AGENT CDK7, CDK17, CDK6 SMN1; SMN2 3221/4885MCHR1 4331/4885EGFR 1287/4885
US-20240016811-A1 CANCER THERAPY USING A COMBINATION OF CDK7 INHIBITOR WITH AN ANTI-MICROTUBULE AGENT CDK7, CDK17, HDAC7 SMN1; SMN2 1366/4885MCHR1 3254/4885EGFR 2251/4885
US-12331023-B2 Substituted heterocyclyl derivatives as CDK inhibitors CDK19, CDK9, CDK1 SMN1; SMN2 1062/4885MCHR1 3868/4885EGFR 2065/4885
US-20220098156-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors CDK19, CDK9, CDK1 SMN1; SMN2 1062/4885MCHR1 3868/4885EGFR 2065/4885

“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.