SCHEMBL29354288

SCHEMBL29354288

Nc1ccc(Nc2cc(S(=O)(=O)O)c(N)c3c2C(=O)c2ccccc2C3=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GNG2 P59768 5/20 1.00
▸ GNB1 P62873 5/20 1.00
▸ CYP1A2 P05177 2/20 0.81
▸ CYP2C9 P11712 2/20 0.81
▸ ALOX15 P16050 2/20 0.81
▸ HSD17B10 Q99714 2/20 0.81
▸ PHLPP2 Q6ZVD8 2/20 0.77
▸ P2RY4 P51582 9/20 0.71
▸ MET P08581 3/20 0.71
▸ ALDH1A1 P00352 1/20 0.69
▸ CYP3A4 P08684 1/20 0.69
▸ HPGD P15428 1/20 0.69
▸ MAPK1 P28482 1/20 0.69
▸ CYP2C19 P33261 1/20 0.69
▸ HIF1A Q16665 1/20 0.69
▸ P2RY12 Q9H244 6/20 0.67
▸ P2RY2 P41231 6/20 0.67
▸ P2RY6 Q15077 4/20 0.67
▸ ENTPD1 P49961 2/20 0.67
▸ HGF P14210 2/20 0.66

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
SCHEMBL2778161 1.00 GNG2 (1.00) GNG2GNB1CYP1A2CYP2C9ALOX15
SCHEMBL3029899 0.99 GNG2 (0.97) GNG2GNB1CYP1A2CYP2C9ALOX15
SCHEMBL13021512 0.96 GNG2 (0.92) GNG2GNB1CYP1A2CYP2C9ALOX15
SCHEMBL13891732 0.93 GNG2 (0.86) GNG2GNB1CYP1A2CYP2C9ALOX15
SCHEMBL13213975 0.92 GNG2 (0.86) GNG2GNB1CYP1A2CYP2C9ALOX15
SCHEMBL29357302 0.92 GNG2 (0.85) GNG2GNB1CYP1A2CYP2C9ALOX15
SCHEMBL791019 0.92 GNG2 (0.85) GNG2GNB1CYP1A2CYP2C9ALOX15
SCHEMBL7765342 0.91 GNG2 (0.84) GNG2GNB1CYP1A2CYP2C9ALOX15
SCHEMBL29355106 0.91 GNG2 (0.84) GNG2GNB1CYP1A2CYP2C9ALOX15
SCHEMBL10708708 0.91 GNG2 (0.84) GNG2GNB1CYP1A2CYP2C9ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025073290-A1 VPS4 INHIBITORS AND METHODS OF USE THEREOF PARA THERAPEUTICS, INC. (US) 2025-04-10 — — WO claimed
WO-2022086892-A1 INTERLEUKIN 4 (IL4)-INDUCED GENE 1 INHIBITORS AND METHODS OF USE THEREOF CALITHERA BIOSCIENCES, INC. (US) 2022-04-28 — — WO claimed
EP-3986894-A1 ECTONUCLEOTIDASE INHIBITORS AND METHODS OF USE THEREOF Calithera Biosciences, Inc. (US) 2022-04-27 — — EP claimed
EP-4605397-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS Nuvalent, Inc. (US) 2025-08-27 — — EP disclosed
EP-4568969-A1 HETEROAROMATIC MACROCYCLIC ETHER COMPOUNDS Nuvalent, Inc. (US) 2025-06-18 — — EP disclosed
CN-120035594-A Heteroaromatic macrocyclic ether chemotherapeutic agents 纽威伦特公司 2025-05-23 — — CN disclosed
WO-2025073290-A1 VPS4 INHIBITORS AND METHODS OF USE THEREOF PARA THERAPEUTICS, INC. (US) 2025-04-10 — — WO disclosed
WO-2025072117-A1 HETEROAROMATIC MACROCYCLIC ETHER COMPOUNDS AND ISOTOPOLOGUES THEREOF NUVALENT, INC. (US) 2025-04-03 — — WO disclosed
WO-2025072120-A1 HETEROAROMATIC MACROCYCLIC ETHER COMPOUNDS NUVALENT, INC. (US) 2025-04-03 — — WO disclosed
EP-4504189-A1 METHODS OF TREATING SOLID TUMOR USING (19R)-5-CHLORO-3-ETHYL-16-FLUORO-10,19-DIMETHYL-20-OXA-3,4,10,11,23-PENTAAZAPENTACYCLO[19.3.1.02,6.08,12.013,18]PENTACOSA-1(24),2(6),4,8,11,13,15,17,21(25),22-DECAEN-22-AMINE Nuvalent, Inc. (US) 2025-02-12 — — EP disclosed
EP-4504736-A1 SOLID FORMS, PHARMACEUTICAL COMPOSITIONS AND PREPARATION OF HETEROAROMATIC MACROCYCLIC ETHER COMPOUNDS Nuvalent, Inc. (US) 2025-02-12 — — EP disclosed
CN-113811310-B Compositions comprising phosphorus derivatives of nicotinamide riboside and methods for modulating nicotinamide adenine dinucleotide 麦德龙国际生物科技有限责任公司 2023-03-24 — — CN disclosed
EP-4146626-A2 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS Nuvalent, Inc. (US) 2023-03-15 — — EP disclosed
EP-4146205-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS Nuvalent, Inc. (US) 2023-03-15 — — EP disclosed
CN-110234656-B Exonucleotidase inhibitors and methods of use thereof 卡利泰拉生物科技公司 2023-02-28 — — CN disclosed
WO-2022221227-A1 AMINO-SUBSTITUTED HETEROCYCLES FOR TREATING CANCERS WITH EGFR MUTATIONS NUVALENT, INC. (US) 2022-10-20 — — WO disclosed
CN-114555619-A Compounds and compositions for differential modulation of nicotinamide adenine dinucleotide 麦德龙国际生物科技有限责任公司 2022-05-27 — — CN disclosed
WO-2022086892-A1 INTERLEUKIN 4 (IL4)-INDUCED GENE 1 INHIBITORS AND METHODS OF USE THEREOF CALITHERA BIOSCIENCES, INC. (US) 2022-04-28 — — WO disclosed
EP-3986894-A1 ECTONUCLEOTIDASE INHIBITORS AND METHODS OF USE THEREOF Calithera Biosciences, Inc. (US) 2022-04-27 — — EP disclosed
EP-3941481-A1 COMPOSITIONS COMPRISING A PHOSPHORUS DERIVATIVE OF NICOTINAMIDE RIBOSIDE AND METHODS FOR MODULATION OF NICOTINAMIDE ADENINE DINUCLEOTIDE Metro International Biotech, LLC (US) 2022-01-26 — — EP disclosed
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