SCHEMBL1981682

SCHEMBL1981682

N#CC1CNc2ccccc2O1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 2/20 0.46
HPGD P15428 1/20 0.44
BRD4 O60885 1/20 0.40
CREBBP Q92793 1/20 0.40
PARP1 P09874 1/20 0.40
CASR P41180 1/20 0.39
GAA P10253 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HTR1A P08908 3/20 0.36
ALOX5 P09917 1/20 0.33
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HTR5A P47898 1/20 0.30

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
SCHEMBL8564068 1.00 NISCH (0.46) NISCHHPGDBRD4CREBBPPARP1
SCHEMBL8564064 1.00 NISCH (0.46) NISCHHPGDBRD4CREBBPPARP1
SCHEMBL2936539 0.84 HPGD (0.47) NISCHHPGDBRD4CREBBPPARP1
SCHEMBL19392968 0.77 BRD4 (0.54) NISCHHPGDBRD4CREBBPPARP1
SCHEMBL517074 0.77 BRD4 (0.54) NISCHHPGDBRD4CREBBPPARP1
SCHEMBL15158184 0.74 HPGD (0.48) NISCHHPGDBRD4CREBBPPARP1
SCHEMBL1190290 0.74 OTUD7B (0.36) NISCH
SCHEMBL15718086 0.73 NISCH (0.49) NISCHHPGDBRD4CREBBPPARP1
SCHEMBL214287 0.73 NISCH (0.49) NISCHHPGDBRD4CREBBPPARP1
SCHEMBL3966534 0.73 NISCH (0.49) NISCHHPGDBRD4CREBBPPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2917194-B1 NOVEL BENZYL SULFONAMIDE COMPOUNDS USEFUL AS MOGAT-2 INHIBITORS LILLY CO ELI (US) 2017-09-27 EP disclosed
EP-2917194-B1 NOVEL BENZYL SULFONAMIDE COMPOUNDS USEFUL AS MOGAT-2 INHIBITORS LILLY CO ELI (US) 2017-09-27 EP disclosed
US-9416138-B2 Benzyl sulfonamide compounds useful as MoGAT-2 inhibitors ELI LILLY AND COMPANY (US) 2016-08-16 US disclosed
US-9416138-B2 Benzyl sulfonamide compounds useful as MoGAT-2 inhibitors ELI LILLY AND COMPANY (US) 2016-08-16 US disclosed
US-9416138-B2 Benzyl sulfonamide compounds useful as MoGAT-2 inhibitors ELI LILLY AND COMPANY (US) 2016-08-16 US disclosed
US-20150284404-A1 NOVEL BENZYL SULFONAMIDE COMPOUNDS USEFUL AS MOGAT-2 INHIBITORS ELI LILLY AND COMPANY 2015-10-08 US disclosed
US-20150284404-A1 NOVEL BENZYL SULFONAMIDE COMPOUNDS USEFUL AS MOGAT-2 INHIBITORS ELI LILLY AND COMPANY 2015-10-08 US disclosed
US-20150284404-A1 NOVEL BENZYL SULFONAMIDE COMPOUNDS USEFUL AS MOGAT-2 INHIBITORS ELI LILLY AND COMPANY 2015-10-08 US disclosed
EP-2917194-A1 NOVEL BENZYL SULFONAMIDE COMPOUNDS USEFUL AS MOGAT-2 INHIBITORS Eli Lilly and Company (US) 2015-09-16 EP disclosed
WO-2014074365-A1 NOVEL BENZYL SULFONAMIDE COMPOUNDS USEFUL AS MOGAT-2 INHIBITORS ELI LILLY AND COMPANY (US) 2014-05-15 WO disclosed
WO-2014074365-A1 NOVEL BENZYL SULFONAMIDE COMPOUNDS USEFUL AS MOGAT-2 INHIBITORS ELI LILLY AND COMPANY (US) 2014-05-15 WO disclosed
US-8440691-B2 Tetrahydroquinolinyl compounds that inhibit vanilloid receptor subtype 1 (VR1) receptor and uses thereof ABBVIE INC. (US) 2013-05-14 US disclosed
EP-2527339-A1 Chromanylurea compounds that inhibit vanilloid receptor subtype 1 (VR1) receptor and uses thereof Abbott Laboratories (US) 2012-11-28 EP disclosed
US-20110152250-A1 CHROMANYLUREA COMPOUNDS THAT INHIBIT VANILLOID RECEPTOR SUBTYPE 1 (VR1) RECEPTOR AND USES THEREOF ABBOTT LABORATORIES (US) 2011-06-23 US disclosed
US-7812019-B2 Chromanylurea compounds that inhibit vanilloid receptor subtype 1 (VR1) receptor and uses thereof ABBOTT LABORATORIES (US) 2010-10-12 US disclosed
US-20060128689-A1 Chromanylurea compounds that inhibit vanilloid receptor subtype 1 (VR1) receptor and uses thereof ABBVIE INC. 2006-06-15 US disclosed
US-6699695-B1 FOR EXAMPLE, CONVERTING 2-HYDROXY-4-METHYLTHIOBUTYRONITRILE INTO THE CORRESPONDING AMIDE, WHICH IS A PRECURSOR TO THE FEED SUPPLEMENT 2-HYDROXY-4-METHYLTHIOBUTYRIC ACID DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2004-03-02 US disclosed
EP-1055724-A1 MICROORGANISMS AND PROCESS FOR PRODUCING AMIDE COMPOUNDS Daicel Chemical Industries, Ltd. (JP) 2000-11-29 EP 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 (3 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-20060128689-A1 Chromanylurea compounds that inhibit vanilloid receptor subtype 1 (VR1) receptor and uses thereof CACNA1E, CACNA1D, CACNA1S NISCH 1646/4885HPGD 3370/4885BRD4 3228/4885
US-20150284404-A1 NOVEL BENZYL SULFONAMIDE COMPOUNDS USEFUL AS MOGAT-2 INHIBITORS MOGAT2, SOAT1, SOAT2 NISCH 3375/4885HPGD 4545/4885BRD4 683/4885
US-20110152250-A1 CHROMANYLUREA COMPOUNDS THAT INHIBIT VANILLOID RECEPTOR SUBTYPE 1 (VR1) RECEPTOR AND USES THEREOF CACNA1E, CACNA1D, CACNA1S NISCH 1646/4885HPGD 3370/4885BRD4 3228/4885

“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.