SCHEMBL4428995

SCHEMBL4428995

O=CCN1C(=O)COc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.57
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.53
ALDH1A1 P00352 3/20 0.51
POLB P06746 2/20 0.51
LMNA P02545 1/20 0.51
CBX7 O95931 1/20 0.50
CDYL2 Q8N8U2 1/20 0.50
CDYL Q9Y232 1/20 0.50
CDY1; CDY1B Q9Y6F8 1/20 0.50
PRMT5 O14744 1/20 0.50
WDR77 Q9BQA1 1/20 0.50
HTT P42858 1/20 0.49
USP2 O75604 1/20 0.49
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
DRD4 P21917 1/20 0.49
ALOX12 P18054 1/20 0.48

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
SCHEMBL474524 0.86 TSHR (0.56) TSHRMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL24855242 0.80 TSHR (0.44) TSHRMEN1KMT2AL3MBTL1CBX7
SCHEMBL474614 0.80 TSHR (0.60) TSHRMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL10530282 0.79 CHRM1 (0.49) TSHRALDH1A1KDM4EGAAMAPT
SCHEMBL15690661 0.77 ALDH1A1 (0.58) TSHRMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL9214610 0.77 ALDH1A1 (0.58) TSHRMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL7358743 0.77 ALDH1A1 (0.61) TSHRMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL3641417 0.77 ALDH1A1 (0.58) TSHRMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL10374294 0.76 TSHR (0.56) TSHRMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL4970176 0.76 KMT2A (0.68) TSHRMEN1KMT2AALDH1A1POLB

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
US-8759342-B2 Benzo[1,4]oxazin-3-one, benzo[1,4]thiazin-3-one and quinolin-2-one urotensin II receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2014-06-24 US disclosed
US-8759342-B2 Benzo[1,4]oxazin-3-one, benzo[1,4]thiazin-3-one and quinolin-2-one urotensin II receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2014-06-24 US disclosed
US-8759342-B2 Benzo[1,4]oxazin-3-one, benzo[1,4]thiazin-3-one and quinolin-2-one urotensin II receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2014-06-24 US 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
EP-2049120-A1 UROTENSIN II RECEPTOR ANTAGONISTS Janssen Pharmaceutica, N.V. (BE) 2009-04-22 EP disclosed
US-20080039454-A1 Urotensin II receptor antagonists JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-14 US disclosed
WO-2008016534-A1 UROTENSIN II RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-07 WO disclosed
WO-2008016534-A1 UROTENSIN II RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-07 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-20150284404-A1 NOVEL BENZYL SULFONAMIDE COMPOUNDS USEFUL AS MOGAT-2 INHIBITORS MOGAT2, SOAT1, SOAT2 TSHR 2001/4885MEN1 1241/4885KMT2A 132/4885
US-20080039454-A1 Urotensin II receptor antagonists UTS2R, PLAUR, NTSR2 TSHR 527/4885MEN1 2791/4885KMT2A 3204/4885

“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.