SCHEMBL22869715

SCHEMBL22869715

COc1cc(NC(=O)N2CCC(n3c(=O)[nH]c4ccccc43)CC2)ccc1C

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 11/20 0.73
ALDH1A1 P00352 2/20 0.67
CHRM1 P11229 3/20 0.58
MAPK1 P28482 2/20 0.57
LMNA P02545 1/20 0.57
HTT P42858 1/20 0.57
CHRM2 P08172 1/20 0.55
CHRM4 P08173 1/20 0.55
CHRM5 P08912 1/20 0.55
CHRM3 P20309 1/20 0.55
OPRM1 P35372 1/20 0.54
OPRD1 P41143 1/20 0.54
OPRL1 P41146 1/20 0.54
OPRK1 P41145 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
SCHEMBL30870193 0.88 HSD11B1 (0.74) HSD11B1ALDH1A1CHRM1
SCHEMBL22869508 0.88 HSD11B1 (0.74) HSD11B1ALDH1A1CHRM1
SCHEMBL30870358 0.88 HSD11B1 (0.66) HSD11B1ALDH1A1CHRM1
SCHEMBL22869654 0.88 HSD11B1 (0.66) HSD11B1ALDH1A1CHRM1
SCHEMBL22869573 0.86 HSD11B1 (0.64) HSD11B1ALDH1A1LMNAOPRM1OPRD1
SCHEMBL30870573 0.86 HSD11B1 (0.64) HSD11B1ALDH1A1LMNAOPRM1OPRD1
SCHEMBL28905074 0.86 HSD11B1 (0.64) HSD11B1ALDH1A1LMNAOPRM1OPRD1
SCHEMBL22869849 0.85 HSD11B1 (0.65) HSD11B1ALDH1A1CHRM1
SCHEMBL22869513 0.85 HSD11B1 (0.63) HSD11B1ALDH1A1CHRM1HTTOPRM1
SCHEMBL30870262 0.85 HSD11B1 (0.65) HSD11B1ALDH1A1CHRM1

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
CN-112074511-A Substituted benzodiazoles and their use in therapy 托马斯·黑勒戴药物研究基金会 2020-12-11 CN claimed
US-20210002250-A1 SUBSTITUTED BENZODIAZOLES AND USE THEREOF IN THERAPY THOMAS HELLEDAYS STIFTELSE FÖR MEDICINSK FORSKNING (SE) 2021-01-07 US disclosed
CN-112074511-A Substituted benzodiazoles and their use in therapy 托马斯·黑勒戴药物研究基金会 2020-12-11 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-20210002250-A1 SUBSTITUTED BENZODIAZOLES AND USE THEREOF IN THERAPY XDH, CYP4X1, CYP11B2 HSD11B1 256/4885ALDH1A1 330/4885CHRM1 816/4885

“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.