SCHEMBL23081092

SCHEMBL23081092

CC(=O)NC1CCCC(C(C)C)C1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 1/20 0.50
ATM Q13315 3/20 0.44
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
TLR4 O00206 1/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
EPHX1 P07099 4/20 0.36
BTK Q06187 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
DHODH Q02127 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
SCHEMBL14519187 1.00 ALDH1A1 (0.50) ALDH1A1KDM4EATMCA1CA2
SCHEMBL25444128 1.00 ALDH1A1 (0.50) ALDH1A1KDM4EATMCA1CA2
SCHEMBL14519179 1.00 ALDH1A1 (0.50) ALDH1A1KDM4EATMCA1CA2
SCHEMBL23259954 1.00 ALDH1A1 (0.50) ALDH1A1KDM4EATMCA1CA2
SCHEMBL25444531 0.90 ATM (0.46) ALDH1A1KDM4EATMCA1CA2
SCHEMBL26781677 0.85 BTK (0.39) ALDH1A1KDM4EATMEPHX1BTK
SCHEMBL21161443 0.84 ATM (0.50) ALDH1A1KDM4EATMCA1CA2
SCHEMBL10217397 0.84 ATM (0.50) ALDH1A1KDM4EATMCA1CA2
SCHEMBL7894278 0.84 ATM (0.50) ALDH1A1KDM4EATMCA1CA2
SCHEMBL283828 0.83 ALDH1A1 (0.61) ALDH1A1KDM4EATMCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348518-A1 HELICASE INHIBITORS FOR TREATMENT OF MEDICAL DISORDERS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2023-11-02 US disclosed
US-20230242543-A1 CDK Inhibitors And Their Use As Pharmaceuticals PRELUDE THERAPEUTICS INCORPORATED 2023-08-03 US disclosed
US-20230242543-A1 CDK Inhibitors And Their Use As Pharmaceuticals PRELUDE THERAPEUTICS INCORPORATED 2023-08-03 US disclosed
US-11673893-B2 CDK inhibitors and their use as pharmaceuticals PRELUDE THERAPEUTICS INCORPORATED (US) 2023-06-13 US disclosed
US-11673893-B2 CDK inhibitors and their use as pharmaceuticals PRELUDE THERAPEUTICS INCORPORATED (US) 2023-06-13 US disclosed
US-20230144528-A1 CDK Inhibitors And Their Use As Pharmaceuticals PRELUDE THERAPEUTICS, INCORPORATED 2023-05-11 US disclosed
US-20230144528-A1 CDK Inhibitors And Their Use As Pharmaceuticals PRELUDE THERAPEUTICS, INCORPORATED 2023-05-11 US disclosed
US-20210070761-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS PRELUDE THERAPEUTICS INCORPORATED 2021-03-11 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-11673893-B2 CDK inhibitors and their use as pharmaceuticals CDK6, CDK3, CDK9 ALDH1A1 4032/4885KDM4E 284/4885ATM 233/4885
US-20230144528-A1 CDK Inhibitors And Their Use As Pharmaceuticals CDK6, CDK3, CDK9 ALDH1A1 4032/4885KDM4E 284/4885ATM 233/4885
US-20230348518-A1 HELICASE INHIBITORS FOR TREATMENT OF MEDICAL DISORDERS RECQL, DDX21, DDX41 ALDH1A1 3786/4885KDM4E 1558/4885ATM 923/4885
US-20230242543-A1 CDK Inhibitors And Their Use As Pharmaceuticals CDK6, CDK3, CDK9 ALDH1A1 4032/4885KDM4E 284/4885ATM 233/4885
US-20210070761-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS CDK6, CDK3, CDK9 ALDH1A1 4032/4885KDM4E 284/4885ATM 233/4885

“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.