SCHEMBL25386281

SCHEMBL25386281

CC(C)OC(=O)c1ccc2c(n1)NC([C@H](C)Cl)N2CC1CCO1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ GLA P06280 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ CASP1 P29466 2/20 0.39
▸ CASP7 P55210 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ KMT2A Q03164 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ CNR2 P34972 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ NPSR1 Q6W5P4 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
SCHEMBL25386279 1.00 ALDH1A1 (0.39) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL25386278 1.00 ALDH1A1 (0.39) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL30149256 1.00 ALDH1A1 (0.39) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL28934101 0.88 TRPA1 (0.32) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL28934100 0.88 TRPA1 (0.32) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL29668584 0.88 TRPA1 (0.32) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL28934099 0.88 TRPA1 (0.32) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL30951871 0.73 ALDH1A1 (0.44) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL29261125 0.73 ALDH1A1 (0.44) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL29261124 0.73 ALDH1A1 (0.44) ALDH1A1KDM4EGLAGAAHPGD

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
US-20240246959-A1 BENZIMIDAZOLE DERIVATIVE AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF SHENZHEN SALUBRIS PHARMACEUTICALS CO., LTD. (CN) 2024-07-25 — — US disclosed
CN-115461334-B Benzimidazole derivative, and preparation method and medical application thereof 深圳信立泰药业股份有限公司 2024-06-21 — — CN disclosed
EP-4242202-A1 BENZIMIDAZOLE DERIVATIVE AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF Shenzhen Salubris Pharmaceuticals Co., Ltd. (CN) 2023-09-13 — — 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-20240246959-A1 BENZIMIDAZOLE DERIVATIVE AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF GLP1R, GIPR, GCGR ALDH1A1 1985/4885KDM4E 3725/4885GLA 2876/4885

“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.

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