SCHEMBL23900316

SCHEMBL23900316

O=C(COc1cc(C(=O)O)[nH]c(=O)n1)NC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.46
HPGD P15428 2/20 0.45
TSHR P16473 1/20 0.45
PDE3B Q13370 2/20 0.44
PDE3A Q14432 2/20 0.44
P2RY12 Q9H244 2/20 0.44
PDE2A O00408 1/20 0.44
KMT2A Q03164 5/20 0.43
MEN1 O00255 3/20 0.43
DHODH Q02127 1/20 0.42
CNR2 P34972 1/20 0.42
LMNA P02545 2/20 0.41
HTT P42858 2/20 0.41
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
THRB P10828 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PTPRC P08575 1/20 0.41
PTPN1 P18031 1/20 0.41
PTPN11 Q06124 1/20 0.41

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
SCHEMBL23900315 0.86 ALDH1A1 (0.52) ALDH1A1HPGDTSHRPDE3BPDE3A
SCHEMBL23900436 0.85 MAPT (0.49) ALDH1A1HPGDTSHRPDE3BPDE3A
SCHEMBL23900453 0.85 ALDH1A1 (0.46) ALDH1A1HPGDTSHRPDE3BPDE3A
SCHEMBL23884293 0.83 ALDH1A1 (0.45) ALDH1A1HPGDTSHRPDE3BPDE3A
SCHEMBL23900440 0.83 ALDH1A1 (0.44) ALDH1A1HPGDTSHRPDE3BPDE3A
SCHEMBL23884315 0.83 ALDH1A1 (0.44) ALDH1A1HPGDTSHRPDE3BPDE3A
SCHEMBL23884357 0.83 ALDH1A1 (0.48) ALDH1A1HPGDTSHRPDE3BPDE3A
SCHEMBL23900296 0.83 ALDH1A1 (0.45) ALDH1A1HPGDTSHRPDE3BPDE3A
SCHEMBL23884375 0.83 PTPRC (0.46) ALDH1A1HPGDTSHRPDE3BPDE3A
SCHEMBL23884346 0.82 PDE3B (0.46) ALDH1A1HPGDTSHRPDE3BPDE3A

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-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
WO-2021203048-A1 NOVEL 2-PYRIMIDONE ANALOGS AS POTENT ANTIVIRAL AGENTS AGAINST ALPHAVIRUSES SOUTHERN RESEARCH INSTITUTE (US) 2021-10-07 WO 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 ALDH1A1 492/4885HPGD 1775/4885TSHR 4534/4885
US-11566019-B2 2-pyrimidone analogs as potent antiviral agents against alphaviruses EIF2AK2, ZC3HAV1, MAVS ALDH1A1 492/4885HPGD 1775/4885TSHR 4534/4885
US-20220177452-A9 2-Pyrimidone Analogs as Potent Antiviral Agents Against Alphaviruses EIF2AK2, ZC3HAV1, MAVS ALDH1A1 492/4885HPGD 1775/4885TSHR 4534/4885

“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.