Benzimidazole

Benzimidazole

SCHEMBL3534083

Oc1cccc2[nH]ccc12.c1ccc2[nH]cnc2c1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 2/20 0.47
QPCTL Q9NXS2 1/20 0.47
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
PARP1 P09874 2/20 0.40
HPGD P15428 2/20 0.40
RAB9A P51151 2/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
BLM P54132 1/20 0.40
PARP15 Q460N3 1/20 0.40
HSD17B10 Q99714 1/20 0.40
AHR P35869 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
PDPK1 O15530 1/20 0.38
CA12 O43570 1/20 0.38
ALOX15 P16050 1/20 0.38
CA9 Q16790 1/20 0.38

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
Benzimidazole SCHEMBL4876376 0.83 QPCT (0.57) QPCTQPCTLKDM4EALDH1A1PARP1
SCHEMBL29363007 0.81 AHR (0.56) KDM4EALDH1A1PARP1HPGDRAB9A
SCHEMBL9232128 0.81 AHR (0.56) KDM4EALDH1A1PARP1HPGDRAB9A
SCHEMBL26495 0.81 AHR (0.56) KDM4EALDH1A1PARP1HPGDRAB9A
SCHEMBL25177318 0.79 AHR (0.54) KDM4EALDH1A1PARP1HPGDRAB9A
Hydrochloric Acid SCHEMBL8356509 0.79 AHR (0.54) KDM4EALDH1A1PARP1HPGDRAB9A
Iodide SCHEMBL30373944 0.79 AHR (0.54) KDM4EALDH1A1PARP1HPGDRAB9A
Benzimidazole SCHEMBL3536974 0.79 QPCT (0.44) QPCTQPCTLKDM4EALDH1A1HPGD
Benzimidazole SCHEMBL6009 0.77
Benzimidazole SCHEMBL461969 0.77 SMN1; SMN2 (0.50) QPCTQPCTLKDM4EALDH1A1PARP1

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
US-7642278-B2 Nitrogen compounds such as 3-(5-morpholin-4-yl-1H-benz-imidazol-2-yl)-1H-indazole and/or isomers, used as immunology modulators, antidiabetic agents, antiogenesis inhibitors or for prophylaxis of Alzheimer's disease NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-01-05 US disclosed
US-7064215-B2 Indazole benzimidazole compounds CHIRON CORPORATION (US) 2006-06-20 US disclosed
US-20060079564-A1 Indazole benzimidazole compounds CHIRON CORPORATION 2006-04-13 US disclosed
EP-1401831-A1 INDAZOLE BENZIMIDAZOLE COMPOUNDS AS TYROSINE AND SERINE/THREONINE KINASE INHIBITORS CHIRON CORPORATION (US) 2004-03-31 EP disclosed
US-20030207883-A1 Indazole benzimidazole compounds CHIRON CORPORATION 2003-11-06 US disclosed
WO-2003004488-A1 INDAZOLE BENZIMIDAZOLE COMPOUNDS AS TYROSINE AND SERINE/THREONINE KINASE INHIBITORS CHIRON CORPORATION (US) 2003-01-16 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-20060079564-A1 Indazole benzimidazole compounds ABL1, ABL2, ALK QPCT 1549/4885QPCTL 2609/4885KDM4E 2648/4885
US-20030207883-A1 Indazole benzimidazole compounds SLCO1B3, SLCO1B1, SLCO4C1 QPCT 2707/4885QPCTL 4249/4885KDM4E 3618/4885

“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.