SCHEMBL21774243

SCHEMBL21774243

NC(=O)Nc1ccc2nc[nH]c2c1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 8/20 0.63
NAMPT P43490 1/20 0.60
RAB9A P51151 3/20 0.59
TP53 P04637 1/20 0.59
MAPT P10636 1/20 0.59
ATM Q13315 1/20 0.59
EPHX1 P07099 2/20 0.58
NPC1 O15118 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
P2RY14 Q15391 4/20 0.55
CYP3A4 P08684 1/20 0.55
P2RY6 Q15077 1/20 0.55
POLB P06746 2/20 0.55
HTT P42858 1/20 0.55

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
SCHEMBL5265936 0.85 NAMPT (0.66) QPCTNAMPTRAB9ATP53MAPT
SCHEMBL6205265 0.84 QPCT (0.58) QPCTNAMPTRAB9ATP53MAPT
SCHEMBL11580425 0.84 QPCT (0.63) QPCTNAMPTRAB9ATP53MAPT
SCHEMBL27548486 0.80 NAMPT (0.67) QPCTNAMPTRAB9ATP53MAPT
SCHEMBL9059907 0.79 NAMPT (0.66) QPCTNAMPTRAB9ATP53MAPT
SCHEMBL30050799 0.79 QPCT (0.75) QPCTNAMPTRAB9ATP53MAPT
Phenylurea SCHEMBL28171638 0.78 GAA (0.51) QPCTNAMPTRAB9ATP53MAPT
SCHEMBL24819770 0.78 QPCT (0.56) QPCTNAMPTRAB9ATP53MAPT
SCHEMBL6625320 0.78 ADRA2A (0.58) QPCTNAMPTRAB9ATP53MAPT
SCHEMBL19558132 0.78 ADRA2A (0.58) QPCTNAMPTRAB9ATP53MAPT

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 6 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
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
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
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

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 QPCT 9/4885NAMPT 602/4885RAB9A 1639/4885
US-10584120-B1 Benzimidazole compounds and use thereof for treating Alzheimer's Disease or Huntington's Disease GLUL, GLS2, GLS QPCT 9/4885NAMPT 602/4885RAB9A 1639/4885

“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.