SCHEMBL5844930

SCHEMBL5844930

OCCNc1nc2ccccc2[nH]1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.67
TRPC3 Q13507 1/20 0.67
TRPC4 Q9UBN4 1/20 0.67
TRPC5 Q9UL62 1/20 0.67
TSHR P16473 2/20 0.62
TP53 P04637 1/20 0.61
RAB9A P51151 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
ALDH1A1 P00352 1/20 0.58
POLB P06746 1/20 0.56
TDP1 Q9NUW8 1/20 0.55
ALPL P05186 2/20 0.53
ALPG P10696 2/20 0.53
PLAA Q9Y263 1/20 0.53
KDM4E B2RXH2 1/20 0.53
MAPK1 P28482 1/20 0.53
CYP3A4 P08684 1/20 0.53
LMNA P02545 1/20 0.53
KCNH2 Q12809 1/20 0.52

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
SCHEMBL8492186 0.90 BCHE (0.72) BCHETRPC3TRPC4TRPC5TSHR
SCHEMBL17329389 0.85 BCHE (0.57) BCHETRPC3TRPC4TRPC5TSHR
SCHEMBL14638914 0.83 BCHE (0.67) BCHETRPC3TRPC4TRPC5TSHR
SCHEMBL19374547 0.83 BCHE (0.67) BCHETRPC3TRPC4TRPC5TSHR
SCHEMBL8464091 0.83 BCHE (0.82) BCHETRPC3TRPC4TRPC5TSHR
SCHEMBL4422048 0.83 BCHE (0.67) BCHETRPC3TRPC4TRPC5TSHR
SCHEMBL7217435 0.81 BCHE (0.60) BCHETRPC3TRPC4TRPC5TSHR
SCHEMBL22619945 0.80 BCHE (1.00) BCHETRPC3TRPC4TRPC5TSHR
SCHEMBL14068347 0.80 BCHE (0.72) BCHETRPC3TRPC4TRPC5TSHR
SCHEMBL2674051 0.80 RAB9A (0.71) BCHETRPC3TRPC4TRPC5TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9139567-B2 Arylpyrazole ethers as inhibitors of leukotriene A4 hydrolase BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-09-22 US claimed
US-20140221373-A1 ARYLPYRAZOLE ETHERS AS INHIBITORS OF LEUKOTRIENE A4 HYDROLASE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-08-07 US claimed
EP-2734516-A1 ARYLPYRAZOLE ETHERS AS INHIBITORS OF LEUKOTRIENE A4 HYDROLASE Boehringer Ingelheim International GmbH (DE) 2014-05-28 EP claimed
WO-2013012844-A1 ARYLPYRAZOLE ETHERS AS INHIBITORS OF LEUKOTRIENE A4 HYDROLASE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-01-24 WO claimed
US-20220226304-A1 Treatment of Aging-Associated Disease with Modulators of Leukotriene A4 Hydrolase ALKAHEST, INC. 2022-07-21 US disclosed
US-20220218839-A1 SELECTIVE UV CROSSLINKING OF PEPTIDES AND FUNCTIONAL MOIETIES TO IMMUNOGLOBULINS UNIVERSITY OF NOTRE DAME DU LAC (US) 2022-07-14 US disclosed
US-11344542-B2 Treatment of aging-associated disease with modulators of leukotriene A4 hydrolase ALKAHEST, INC. (US) 2022-05-31 US disclosed
US-11116848-B2 Selective UV crosslinking of peptides and functional moieties to immunoglobulins UNIVERSITY OF NOTRE DAME DU LAC (US) 2021-09-14 US disclosed
US-20200368220-A1 Treatment of Aging-Associated Disease with Modulators of Leukotriene A4 Hydrolase ALKAHEST, INC. 2020-11-26 US disclosed
US-20190350917-A1 Treatment of Aging-Associated Disease with Modulators of Leukotriene A4 Hydrolase ALKAHEST, INC. 2019-11-21 US disclosed
EP-2970440-B1 SELECTIVE UV CROSSLINKING OF PEPTIDES AND FUNCTIONAL MOIETIES TO IMMUNOGLOBULINS UNIV NOTRE DAME DU LAC (US) 2019-11-20 EP disclosed
US-20190328896-A1 SELECTIVE UV CROSSLINKING OF PEPTIDES AND FUNCTIONAL MOIETIES TO IMMUNOGLOBULINS UNIVERSITY OF NOTRE DAME DU LAC (US) 2019-10-31 US disclosed
WO-2002050039-A1 UREA AND URETHANE DERIVATIVES AS INTEGRIN INHIBITORS MERCK PATENT GMBH (DE) 2002-06-27 WO disclosed
WO-1999000390-A1 NOVEL BENZIMIDAZOL TRICYCLIC DERIVATIVES, THEIR PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR ET COMPAGNIE (FR) 1999-01-07 WO disclosed
EP-0571253-B1 Benzimidazole derivatives with antidiabetic and antiplatelet aggregation activity ADIR (FR) 1998-11-04 EP disclosed
US-5639756-A ANTIDIABETIC AGENTS ADIR ET COMPAGNIE (FR) 1997-06-17 US disclosed
US-5623073-A ANTIDIABETIC AGENT ADIR ET COMPAGNIE (FR) 1997-04-22 US disclosed
EP-0571253-A1 Benzimidazole derivatives with antidiabetic and antiplatelet aggregation activity ADIR ET COMPAGNIE (FR) 1993-11-24 EP disclosed
US-4204069-A 1-(5-BENZIMIDAZOYL)-2-ISOPROPYLAMINOETHANOL FROM ACETONE AND 1-(5-BENZIMIDAZOYL)-2-AMINOETHANOL MERCK & CO., INC. (US) 1980-05-20 US disclosed
US-4082847-A 1-(5-BENZIMIDAZOLYL)-2-ISOPROPYLAMINOETHANOL, BRONCHODILATION, REDUCING INTRAOCULAR PRESSURE MERCK & CO., INC. (US) 1978-04-04 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 (5 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-11344542-B2 Treatment of aging-associated disease with modulators of leukotriene A4 hydrolase LTA4H, LTB4R, LTC4S BCHE 73/4885TRPC3 1891/4885TRPC4 498/4885
US-20190350917-A1 Treatment of Aging-Associated Disease with Modulators of Leukotriene A4 Hydrolase LTA4H, LTB4R, LTC4S BCHE 73/4885TRPC3 1891/4885TRPC4 498/4885
US-20220226304-A1 Treatment of Aging-Associated Disease with Modulators of Leukotriene A4 Hydrolase LTA4H, LTB4R, LTC4S BCHE 73/4885TRPC3 1891/4885TRPC4 498/4885
US-20140221373-A1 ARYLPYRAZOLE ETHERS AS INHIBITORS OF LEUKOTRIENE A4 HYDROLASE LTA4H, LTC4S, LTB4R BCHE 1042/4885TRPC3 1238/4885TRPC4 512/4885
US-20200368220-A1 Treatment of Aging-Associated Disease with Modulators of Leukotriene A4 Hydrolase LTA4H, LTB4R, LTC4S BCHE 73/4885TRPC3 1891/4885TRPC4 498/4885

“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.