SCHEMBL21774206

SCHEMBL21774206

CC(=O)c1ccc(-c2nc(C(F)(F)F)cs2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ KIF11 P52732 1/20 0.43
▸ SMN1; SMN2 Q16637 5/20 0.42
▸ NPC1 O15118 4/20 0.42
▸ RAB9A P51151 4/20 0.42
▸ SYK P43405 1/20 0.42
▸ RHOC P08134 1/20 0.42
▸ RHOA P61586 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.41
▸ ALOX5 P09917 1/20 0.41
▸ EIF4E P06730 1/20 0.41
▸ MAPT P10636 3/20 0.41
▸ POLB P06746 1/20 0.40
▸ HSD17B1 P14061 1/20 0.40
▸ NTMT1 Q9BV86 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ TP53 P04637 1/20 0.39

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
SCHEMBL27538557 0.86 KDM4E (0.59) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL28745414 0.84 MAPT (0.53) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL21774363 0.82 KDM4E (0.43) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL13404669 0.80 NTMT1 (0.45) SMN1; SMN2NPC1RAB9AMAPTNTMT1
SCHEMBL10916295 0.79 KDM4E (0.49) KDM4EALDH1A1MEN1KMT2AKIF11
SCHEMBL13680487 0.78 ALDH1A1 (0.49) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL18725061 0.76 QPCT (0.38) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL1821848 0.75 ALOX5 (0.60) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL6715127 0.75 BLM (0.51) KDM4EALDH1A1MEN1KMT2ARHOC
SCHEMBL6715124 0.75 BLM (0.51) KDM4EALDH1A1MEN1KMT2ARHOC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113613652-B Benzimidazole compounds and their use in the treatment of alzheimer's disease or huntington's disease 台湾卫生研究院 2022-08-23 — — CN disclosed
CN-113613652-A Benzimidazole compounds and their use for treating alzheimer's disease or huntington's disease 台湾卫生研究院 2021-11-05 — — CN disclosed
EP-3843724-A1 BENZIMIDAZOLE COMPOUNDS AND USE THEREOF FOR TREATING ALZHEIMER'S DISEASE OR HUNTINGTON'S DISEASE National Health Research Institutes (TW) 2021-07-07 — — EP disclosed
US-10584120-B1 Benzimidazole compounds and use thereof for treating Alzheimer's Disease or Huntington's Disease NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2020-03-10 — — US disclosed
US-20200071312-A1 BENZIMIDAZOLE COMPOUNDS AND USE THEREOF FOR TREATING ALZHEIMER'S DISEASE OR HUNTINGTON'S DISEASE NATIONAL HEALTH RES INST (TW) 2020-03-05 — — US disclosed
US-20200071312-A1 BENZIMIDAZOLE COMPOUNDS AND USE THEREOF FOR TREATING ALZHEIMER'S DISEASE OR HUNTINGTON'S DISEASE NATIONAL HEALTH RES INST (TW) 2020-03-05 — — US disclosed
WO-2020047360-A1 BENZIMIDAZOLE COMPOUNDS AND USE THEREOF FOR TREATING ALZHEIMER'S DISEASE OR HUNTINGTON'S DISEASE NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2020-03-05 — — WO disclosed
WO-2020047360-A1 BENZIMIDAZOLE COMPOUNDS AND USE THEREOF FOR TREATING ALZHEIMER'S DISEASE OR HUNTINGTON'S DISEASE NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2020-03-05 — — WO 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-20200071312-A1 BENZIMIDAZOLE COMPOUNDS AND USE THEREOF FOR TREATING ALZHEIMER'S DISEASE OR HUNTINGTON'S DISEASE GLUL, GLS2, GLS KDM4E 1764/4885ALDH1A1 925/4885MEN1 2239/4885
US-10584120-B1 Benzimidazole compounds and use thereof for treating Alzheimer's Disease or Huntington's Disease GLUL, GLS2, GLS KDM4E 1764/4885ALDH1A1 925/4885MEN1 2239/4885

“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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