SCHEMBL27744282

SCHEMBL27744282

C=CC(c1cccnc1)S(=O)(=O)n1cc(C=O)cc1-c1ccccc1F

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 1/20 0.33
▸ CYP3A4 P08684 3/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ GLA P06280 2/20 0.31
▸ GAA P10253 2/20 0.31
▸ HPGD P15428 2/20 0.31
▸ CYP3A5 P20815 2/20 0.31
▸ CYP19A1 P11511 2/20 0.31
▸ CYP11B1 P15538 1/20 0.31
▸ CYP11B2 P19099 1/20 0.31
▸ GNRHR P30968 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ PIM1 P11309 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
SCHEMBL27723333 0.89 — —
SCHEMBL27723267 0.89 SLC22A12 (0.36) CYP3A4CYP2C19GAACYP3A5
SCHEMBL27723227 0.87 GLO1 (0.36) CYP3A4CYP2C19ALDH1A1CYP19A1SMN1; SMN2
SCHEMBL28944101 0.87 KCNA5 (0.33) —
Hydrochloric Acid SCHEMBL27864967 0.86 KCNA5 (0.33) —
SCHEMBL27723217 0.84 NFE2L2 (0.35) NFE2L2
SCHEMBL27744209 0.83 CYP3A4 (0.34) CYP3A4CYP2C19GAAGNRHR
SCHEMBL27744010 0.81 CYP3A4 (0.31) NFE2L2CYP3A4CYP2C19CYP3A5GNRHR
SCHEMBL28031578 0.80 CYP3A4 (0.32) NFE2L2CYP3A4CYP2C19CYP3A5GNRHR
SCHEMBL27723314 0.80 CYP3A4 (0.33) CYP3A4CYP2C19CYP3A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105130955-A Preparation method of Vonoprazan fumarate HAIKOU NANLU MEDICAL TECHNOLOGY CO LTD 2015-12-09 — — CN claimed
CN-104926790-A High-purity Vonoprazan Fumarate compound, intermediate and impurity thereof and preparation methods of high-purity Vonoprazan Fumarate compound, intermediate and impurity JIANGSU AOSAIKANG PHARM CO LTD 2015-09-23 — — CN claimed
CN-104860926-A Preparation method of vonoprazan fumarate ZHEJIANG CHENG YI PHARMACEUTICAL CO LTD 2015-08-26 — — CN claimed
CN-105524046-A Process for producing pyrrole compound TAKEDA PHARMACEUTICAL 2016-04-27 — — CN disclosed
CN-105130955-A Preparation method of Vonoprazan fumarate HAIKOU NANLU MEDICAL TECHNOLOGY CO LTD 2015-12-09 — — CN disclosed
CN-105143187-A Method for producing sulfonyl chloride compound TAKEDA PHARMACEUTICAL 2015-12-09 — — CN disclosed
CN-105085484-A Preparation method of vonoprazan fumarate NANJING GRITPHARMA CO LTD 2015-11-25 — — CN disclosed
CN-104926790-A High-purity Vonoprazan Fumarate compound, intermediate and impurity thereof and preparation methods of high-purity Vonoprazan Fumarate compound, intermediate and impurity JIANGSU AOSAIKANG PHARM CO LTD 2015-09-23 — — CN disclosed
CN-104860926-A Preparation method of vonoprazan fumarate ZHEJIANG CHENG YI PHARMACEUTICAL CO LTD 2015-08-26 — — CN disclosed
CN-104327051-A Crystal form of fumarate of pyrrole derivative SUNCADIA PHARMACEUTICALS CO LTD 2015-02-04 — — CN disclosed
CN-102421753-B Process for preparing azole compounds TAKEDA PHARMACEUTICAL 2014-12-31 — — CN disclosed
CN-104211618-A Process for producing pyrrole compound TAKEDA PHARMACEUTICAL 2014-12-17 — — CN disclosed
CN-102421753-A Process for preparing azole compounds TAKEDA PHARMACEUTICAL 2012-04-18 — — CN disclosed
CN-101300229-B 1-heterocyclylsulfonyl, 2-aminomethyl, 5- (hetero-) aryl substituted 1-h-pyrrole derivatives as acid secretion inhibitors TAKEDA PHARMACEUTICAL 2011-10-05 — — CN disclosed
CN-101300229-A 1-heterocyclylsulfonyl, 2-aminomethyl, 5- (hetero-) aryl substituted 1-h-pyrrole derivatives as acid secretion inhibitors TAKEDA PHARMACEUTICAL (JP) 2008-11-05 — — CN disclosed
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