SCHEMBL11246033

SCHEMBL11246033

CCCOc1ccc(N)c(N)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.60
NR4A1 P22736 1/20 0.52
KMT2A Q03164 4/20 0.47
NPC1 O15118 4/20 0.47
MEN1 O00255 3/20 0.47
KDM4E B2RXH2 3/20 0.47
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
HTT P42858 2/20 0.47
ALDH1A1 P00352 2/20 0.47
TP53 P04637 2/20 0.47
GAA P10253 2/20 0.47
USP2 O75604 1/20 0.47
POLB P06746 1/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
ATM Q13315 1/20 0.47

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
SCHEMBL30167072 1.00 MAPT (0.60) MAPTNR4A1KMT2ANPC1MEN1
SCHEMBL30646245 0.92 TSHR (0.53) MAPTNR4A1KMT2ANPC1MEN1
SCHEMBL11655575 0.92 TSHR (0.53) MAPTNR4A1KMT2ANPC1MEN1
SCHEMBL11821808 0.89 NR4A1 (0.61) MAPTNR4A1KMT2ANPC1MEN1
SCHEMBL10430132 0.88 TSHR (0.59) MAPTNR4A1NPC1KDM4ETP53
SCHEMBL6606988 0.86 TSHR (0.62) MAPTNR4A1NPC1KDM4ETP53
SCHEMBL9448760 0.86 TSHR (0.62) MAPTNR4A1NPC1KDM4ETP53
SCHEMBL10187313 0.84 MAPT (0.53) MAPTKMT2ANPC1MEN1KDM4E
SCHEMBL8417912 0.84 MAPT (0.68) MAPTKMT2AMEN1KDM4ECA12
SCHEMBL11806365 0.84 MAPT (0.53) MAPTKMT2ANPC1MEN1KDM4E

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103601685-A Preparation method of oxibendazole CHANGZHOU YABANG QH PHARMACHEM CO LTD 2014-02-26 CN claimed
CN-102250012-B Process for preparing benzimidazole insectifuge oxibendazole JIANGSU BAOZONG BAODA PHARMACEUTICAL CO LTD 2012-12-19 CN claimed
CN-102250012-A Process for preparing benzimidazole insectifuge oxibendazole JIANGSU BAOZONG BAODA PHARMACEUTICAL CO LTD 2011-11-23 CN claimed
WO-2023239007-A1 BENZIMIDAZOLE DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER OR INFECTIOUS DISEASES CONTAINING SAME AS ACTIVE INGREDIENT 한국화학연구원 2023-12-14 WO disclosed
WO-2023239007-A1 BENZIMIDAZOLE DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER OR INFECTIOUS DISEASES CONTAINING SAME AS ACTIVE INGREDIENT 한국화학연구원 2023-12-14 WO disclosed
CN-107709477-B Durable architectural coatings comprising crosslinkable polymeric additives 科慕埃弗西有限公司 2021-10-29 CN disclosed
WO-2015161014-A1 HETEROCYCLIC CGRP RECEPTOR ANTAGONISTS MERCK SHARP & DOHME CORP. (US) 2015-10-22 WO disclosed
CN-103601685-A Preparation method of oxibendazole CHANGZHOU YABANG QH PHARMACHEM CO LTD 2014-02-26 CN disclosed
US-20130018058-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF QUINOLINONE COMPOUNDS HAVING IMPROVED PHARMACEUTICAL PROPERTIES CAI SHAOPEI (US) 2013-01-17 US disclosed
CN-102250012-B Process for preparing benzimidazole insectifuge oxibendazole JIANGSU BAOZONG BAODA PHARMACEUTICAL CO LTD 2012-12-19 CN disclosed
CN-102250012-A Process for preparing benzimidazole insectifuge oxibendazole JIANGSU BAOZONG BAODA PHARMACEUTICAL CO LTD 2011-11-23 CN disclosed
US-7598268-B2 Quinolinone derivatives NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2009-10-06 US disclosed
US-20090181979-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF QUINOLINONE COMPOUNDS HAVING IMPROVED PHARMACEUTICAL PROPERTIES NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2009-07-16 US disclosed
US-7470709-B2 Benzimidazole quinolinones and uses thereof NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-12-30 US disclosed
US-7368459-B2 Heterocyclic compounds CHIRON CORPORATION (US) 2008-05-06 US disclosed
US-20080070906-A1 QUINOLINONE DERIVATIVES NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2008-03-20 US disclosed
US-7335774-B2 Quinolinone derivatives NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-02-26 US disclosed
US-20070032528-A1 Heterocyclic compounds RENHOWE PAUL A 2007-02-08 US disclosed
US-4321393-A Method for preparing 2-cyanamidobenzimidazoles or 2-cyanamidobenzoxazoles SMITHKLINE CORPORATION (US) 1982-03-23 US disclosed
US-4285878-A N-Phenyl-N'-cyano-O-phenylisoureas SMITHKLINE CORPORATION (US) 1981-08-25 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 (4 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-20080070906-A1 QUINOLINONE DERIVATIVES SLCO1B1, SLCO1B3, SLCO1A2 MAPT 1907/4885NR4A1 3931/4885KMT2A 3742/4885
US-20070032528-A1 Heterocyclic compounds SLCO4C1, SLCO2B1, SLCO1B1 MAPT 2281/4885NR4A1 531/4885KMT2A 3768/4885
US-20090181979-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF QUINOLINONE COMPOUNDS HAVING IMPROVED PHARMACEUTICAL PROPERTIES H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RAB14, SLC13A3 MAPT 5/4885NR4A1 3458/4885KMT2A 2881/4885
US-20130018058-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF QUINOLINONE COMPOUNDS HAVING IMPROVED PHARMACEUTICAL PROPERTIES H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RAB14, SLC13A3 MAPT 5/4885NR4A1 3458/4885KMT2A 2881/4885

“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.