SCHEMBL23916966

SCHEMBL23916966

CCC(=O)NC(C)(C)CC(C)(C)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.37
CACNA1H O95180 2/20 0.37
ALDH1A1 P00352 1/20 0.37
EPHX2 P34913 2/20 0.36
LMNA P02545 1/20 0.35
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL21362815 0.71 ALDH1A1 (0.34) CACNA1HALDH1A1LMNAKMT2ASMN1; SMN2
SCHEMBL878777 0.69 POLB (0.46) EPHX1ALDH1A1KMT2ASMN1; SMN2NPSR1
SCHEMBL28206894 0.67 KMT2A (0.34) LMNAKMT2ASMN1; SMN2TSHR
SCHEMBL6865274 0.67 HMGCR (0.38) ALDH1A1EPHX2LMNATSHR
SCHEMBL16592071 0.66 ALDH1A1 (0.39) EPHX1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL14162078 0.66 GRIN2D (0.34) LMNASMN1; SMN2TSHR
SCHEMBL16064880 0.66 LMNA (0.51) EPHX1ALDH1A1LMNAKMT2ASMN1; SMN2
SCHEMBL14118984 0.66 KMT2A (0.33) EPHX1CACNA1HALDH1A1EPHX2LMNA
SCHEMBL10108763 0.65 ALDH1A1 (0.32) ALDH1A1KMT2ATSHR
SCHEMBL20684936 0.65 ALDH1A1 (0.38) ALDH1A1KMT2ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11566019-B2 2-pyrimidone analogs as potent antiviral agents against alphaviruses SOUTHERN RESEARCH INSTITUTE (US) 2023-01-31 US disclosed
US-20220177452-A9 2-Pyrimidone Analogs as Potent Antiviral Agents Against Alphaviruses NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-06-09 US disclosed
US-20210317106-A1 2-Pyrimidone Analogs as Potent Antiviral Agents Against Alphaviruses SOUTHERN RES INST (US) 2021-10-14 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 (3 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-20210317106-A1 2-Pyrimidone Analogs as Potent Antiviral Agents Against Alphaviruses EIF2AK2, ZC3HAV1, MAVS EPHX1 580/4885CACNA1H 2498/4885ALDH1A1 492/4885
US-11566019-B2 2-pyrimidone analogs as potent antiviral agents against alphaviruses EIF2AK2, ZC3HAV1, MAVS EPHX1 580/4885CACNA1H 2498/4885ALDH1A1 492/4885
US-20220177452-A9 2-Pyrimidone Analogs as Potent Antiviral Agents Against Alphaviruses EIF2AK2, ZC3HAV1, MAVS EPHX1 580/4885CACNA1H 2498/4885ALDH1A1 492/4885

“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.