SCHEMBL23927211

SCHEMBL23927211

Fc1cccc(F)c1C1=NCC(=S)Nc2ccc(C(F)(F)F)c(Cl)c21

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 9/20 0.47
ALDH1A1 P00352 1/20 0.39
PKM P14618 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALOX12 P18054 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 1/20 0.33
TRPA1 O75762 1/20 0.32
NOTUM Q6P988 1/20 0.30

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
SCHEMBL23927112 0.88 CHRM1 (0.60) CHRM1ALDH1A1PKMHTTNPSR1
SCHEMBL30202003 0.88 CHRM1 (0.60) CHRM1ALDH1A1PKMHTTNPSR1
SCHEMBL23927191 0.86 LMNA (0.47) LMNANOTUM
SCHEMBL23927186 0.85 CHRM1 (0.43) CHRM1ALDH1A1PKMHTTNPSR1
SCHEMBL23927146 0.85 CHRM1 (0.51) CHRM1ALDH1A1PKMHTTNPSR1
SCHEMBL23881519 0.83 CHRM1 (0.49) CHRM1ALDH1A1PKMHTTNPSR1
SCHEMBL23927116 0.83 CHRM1 (0.49) CHRM1ALDH1A1PKMHTTNPSR1
SCHEMBL30202084 0.83 CHRM1 (0.49) CHRM1ALDH1A1PKMHTTNPSR1
SCHEMBL23927190 0.83 CHRM1 (0.49) CHRM1ALDH1A1PKMHTTNPSR1
SCHEMBL23927158 0.80 CHRM1 (0.50) CHRM1ALDH1A1PKMHTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240287082-A1 NEW BENZODIAZEPINE DERIVATIVES AS GABA A GAMMA1 PAM HOFFMANN-LA ROCHE INC. (US) 2024-08-29 US disclosed
EP-4405043-A1 BENZODIAZEPINE DERIVATIVES AS GABA A GAMMA1 PAM F. Hoffmann-La Roche AG (CH) 2024-07-31 EP disclosed
CN-118043326-A Benzodiazepine derivatives as GABAA γ1 PAM 豪夫迈·罗氏有限公司 2024-05-14 CN disclosed
EP-4139310-B1 BENZODIAZEPINE DERIVATIVES AS GABA A GAMMA1 PAM HOFFMANN LA ROCHE (CH) 2024-03-27 EP disclosed
US-20230141603-A1 BENZODIAZEPINE DERIVATIVES AS GABA A GAMMA1 PAM HOFFMANN-LA ROCHE INC. (US) 2023-05-11 US disclosed
WO-2023046817-A1 BENZODIAZEPINE DERIVATIVES AS GABA A GAMMA1 PAM F. HOFFMANN-LA ROCHE AG (CH) 2023-03-30 WO disclosed
EP-4139310-A1 BENZODIAZEPINE DERIVATIVES AS GABA A GAMMA1 PAM F. Hoffmann-La Roche AG (CH) 2023-03-01 EP disclosed
WO-2021213952-A1 BENZODIAZEPINE DERIVATIVES AS GABA A GAMMA1 PAM F. HOFFMANN-LA ROCHE AG (CH) 2021-10-28 WO disclosed
EP-3901155-A1 NEW BENZODIAZEPINE DERIVATIVES AS GABA A GAMMA1 PAM F. Hoffmann-La Roche AG (CH) 2021-10-27 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 (2 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-20240287082-A1 NEW BENZODIAZEPINE DERIVATIVES AS GABA A GAMMA1 PAM GABRA1, GABRB1, GABRA5 CHRM1 41/4885ALDH1A1 571/4885PKM 487/4885
US-20230141603-A1 BENZODIAZEPINE DERIVATIVES AS GABA A GAMMA1 PAM GABRA1, GABRB1, GABRB3 CHRM1 58/4885ALDH1A1 600/4885PKM 689/4885

“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.