SCHEMBL6973238

SCHEMBL6973238

CC(C)c1nc(C(O)Cc2ccncc2)[nH]c1Sc1cc(Cl)cc(Cl)c1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
GSK3B P49841 2/20 0.32
GCGR P47871 1/20 0.32
KCNH2 Q12809 1/20 0.31

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
Carbamic Acid SCHEMBL4573817 0.94 CDC7 (0.33) CYP3A4GSK3B
SCHEMBL7086339 0.90 TSHR (0.30) GCGR
SCHEMBL7079911 0.90 SLC2A1 (0.34)
SCHEMBL6966853 0.90 TDP1 (0.33)
SCHEMBL6972838 0.88 ADRB2 (0.34)
SCHEMBL7083004 0.88 GSK3B (0.32) CYP1A2CYP3A4CYP2C9CYP2C19GSK3B
SCHEMBL6973659 0.87 MEN1 (0.34) CYP3A4KCNH2
SCHEMBL6960986 0.87 GSK3B (0.32) CYP1A2CYP3A4CYP2C9CYP2C19GSK3B
SCHEMBL7078351 0.85 SLC6A4 (0.36) CYP1A2CYP3A4CYP2C9CYP2C19GSK3B
SCHEMBL597335 0.85 MEN1 (0.31) CYP3A4GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250091995-A1 STABLE CRYSTAL OF 4-OXOQUINOLINE COMPOUND JAPAN TOBACCO INC. (JP) 2025-03-20 US disclosed
EP-2793904-A1 INHIBITORS OF SIALOADHESIN FOR THE TREATMENT OF DISEASES CAUSED BY ENVELOPED VIRUSES Laboratorios Del. Dr. Esteve, S.A. (ES) 2014-10-29 EP disclosed
WO-2013092509-A1 INHIBITORS OF SIALOADHESIN FOR THE TREATMENT OF DISEASES CAUSED BY ENVELOPED VIRUSES LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2013-06-27 WO disclosed
EP-0786455-B1 IMIDAZOLE DERIVATIVE SHIONOGI & CO (JP) 2003-12-03 EP disclosed
US-6147097-A METHOD FOR TREATING AIDS SHIONOGI & CO., LTD. (JP) 2000-11-14 US disclosed
US-5910506-A IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC SHIONOGI & CO., LTD. (JP) 1999-06-08 US disclosed
EP-0786455-A1 IMIDAZOLE DERIVATIVE SHIONOGI & CO., LTD. (JP) 1997-07-30 EP 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-20250091995-A1 STABLE CRYSTAL OF 4-OXOQUINOLINE COMPOUND KCNQ2, KCNQ1, KCNQ5 CYP1A2 40/4885CYP3A4 31/4885CYP2C9 195/4885

“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.