SCHEMBL6792237

SCHEMBL6792237

COc1ccc(/C=C/C=C/C(=O)N2CCCN(C(=O)/C=C/C=C/c3ccc(OC)cc3)CC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 10/20 0.64
KCNH2 Q12809 1/20 0.57
MAPT P10636 1/20 0.57
STAT3 P40763 1/20 0.57
NPC1 O15118 1/20 0.56
ALDH1A1 P00352 1/20 0.56
RAB9A P51151 1/20 0.56
PTGS2 P35354 2/20 0.56
ALOX5 P09917 1/20 0.54
MAOB P27338 1/20 0.54
F3 P13726 1/20 0.54

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
SCHEMBL21957483 0.94 ALOX5 (0.61) GPR183KCNH2STAT3NPC1ALDH1A1
SCHEMBL25307114 0.93 ALOX5 (0.60) GPR183KCNH2STAT3NPC1ALDH1A1
SCHEMBL21428143 0.90 GPR183 (0.62) GPR183KCNH2STAT3NPC1ALDH1A1
SCHEMBL21428073 0.89 GPR183 (0.61) GPR183KCNH2STAT3NPC1ALDH1A1
SCHEMBL21428072 0.87 GPR183 (0.62) GPR183KCNH2STAT3NPC1ALDH1A1
SCHEMBL14441226 0.86 PTGS2 (0.62) GPR183MAPTSTAT3NPC1ALDH1A1
SCHEMBL21427990 0.86 GPR183 (0.61) GPR183KCNH2STAT3NPC1ALDH1A1
SCHEMBL6786761 0.86 ALOX5 (0.57) GPR183MAPTNPC1ALDH1A1RAB9A
SCHEMBL21957510 0.86 GAA (0.61) GPR183KCNH2STAT3NPC1ALDH1A1
SCHEMBL21428450 0.85 NPC1 (0.62) GPR183KCNH2MAPTSTAT3NPC1

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-6828316-B2 Antiallergens KOWA CO., LTD. (JP) 2004-12-07 US disclosed
US-20020042414-A1 Diamide compound and medicine containing the same KOWA CO., LTD. (JP) 2002-04-11 US disclosed
US-6340682-B1 FOR THERAPY OF ALLERGIC IMMUNOLOGICAL DISEASE IS SELECTED FROM ASTHMA, ALLERGIC RHINITIS, INFLAMMATORY LARGE BOWEL DISEASE OR CONTACT DERMATITIS KOWA CO., LTD. (JP) 2002-01-22 US disclosed
EP-0926138-A1 DIAMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME KOWA CO. LTD. (JP) 1999-06-30 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-20020042414-A1 Diamide compound and medicine containing the same HRH4, HRH2, HRH1 GPR183 1153/4885KCNH2 59/4885MAPT 3453/4885

“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.