SCHEMBL23926407

SCHEMBL23926407

O=C1C=CC(=O)N1CCc1ccc(F)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 6/20 0.66
GSK3A P49840 4/20 0.66
GSK3B P49841 4/20 0.66
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CA4 P22748 1/20 0.59
CA9 Q16790 1/20 0.59
ALDH1A1 P00352 3/20 0.54
MAPT P10636 2/20 0.54
PKM P14618 2/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
HSP90AA1 P07900 2/20 0.51
FAAH O00519 4/20 0.50
DAO P14920 1/20 0.47
PARK7 Q99497 1/20 0.46
HPGD P15428 2/20 0.45
TLR9 Q9NR96 1/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL21291908 0.80 MGLL (0.66) MGLLGSK3AGSK3BCA1CA2
SCHEMBL20251099 0.80 MGLL (0.66) MGLLGSK3AGSK3BCA1CA2
SCHEMBL7542262 0.80 MGLL (0.66) MGLLGSK3AGSK3BCA1CA2
SCHEMBL19419960 0.80 GSK3A (0.66) MGLLGSK3AGSK3BCA1CA2
SCHEMBL14677902 0.80 MGLL (0.66) MGLLGSK3AGSK3BCA1CA2
SCHEMBL19555152 0.79 MGLL (0.78) MGLLGSK3AGSK3BCA1CA2
SCHEMBL211905 0.79 GSK3A (1.00) MGLLGSK3AGSK3BCA1CA2
SCHEMBL4154508 0.78 ALDH1A1 (0.61) CA1CA2CA4CA9ALDH1A1
SCHEMBL32665577 0.78 CA1 (0.71) MGLLGSK3AGSK3BCA1CA2
SCHEMBL20375568 0.76 MGLL (0.65) MGLLGSK3AGSK3BCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115197719-B Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal element and method for manufacturing liquid crystal element JSR株式会社 2025-03-28 CN disclosed
CN-115197719-A Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal element, and method for producing same JSR株式会社 2022-10-18 CN disclosed
US-20220064195-A1 SYNTHETIC I2 IMIDAZOLINE RECEPTOR LIGANDS FOR PREVENTION OR TREATMENT OF HUMAN BRAIN DISORDERS UNIVERSITAT DE LES ILLES BALEARS (ES) 2022-03-03 US disclosed
EP-3897838-A1 <SUP2/>? <SUB2/>?2?SYNTHETIC IIMIDAZOLINE RECEPTOR LIGANDS FOR PREVENTION OR TREATMENT OF HUMAN BRAIN DISORDERS Universitat de Barcelona (ES) 2021-10-27 EP disclosed
CN-105130995-B Pyrrolidone compound and its preparation method and application 杭州成邦医药科技有限公司 2017-08-11 CN 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 (1 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-20220064195-A1 SYNTHETIC I2 IMIDAZOLINE RECEPTOR LIGANDS FOR PREVENTION OR TREATMENT OF HUMAN BRAIN DISORDERS CHRM1, GPR3, CHRM3 MGLL 3253/4885GSK3A 2460/4885GSK3B 2454/4885

“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.