SCHEMBL1797197

SCHEMBL1797197

COc1ccc(NCC(=O)O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.59
GAA P10253 2/20 0.59
FFAR1 O14842 1/20 0.58
RAB9A P51151 4/20 0.55
NPC1 O15118 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
KDM4E B2RXH2 2/20 0.54
POLB P06746 1/20 0.54
CA12 O43570 2/20 0.54
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
CA9 Q16790 2/20 0.54
ALDH1A1 P00352 5/20 0.54
HIF1A Q16665 1/20 0.53
PTGS2 P35354 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.51
SAE1 Q9UBE0 1/20 0.50
UBA2 Q9UBT2 1/20 0.50
TP53 P04637 1/20 0.50
ALOX15 P16050 1/20 0.50

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
Hydrochloric Acid SCHEMBL3655605 1.00 MAPT (0.59) MAPTGAAFFAR1RAB9ANPC1
SCHEMBL11288848 0.87 FFAR1 (0.54) MAPTGAAFFAR1RAB9ANPC1
Hydrochloric Acid SCHEMBL5122021 0.87 MAPT (0.57) MAPTGAAFFAR1RAB9ANPC1
Hydrochloric Acid SCHEMBL9527013 0.87 MAPT (0.57) MAPTGAAFFAR1RAB9ANPC1
SCHEMBL28986808 0.85 ALDH1A1 (0.52) MAPTGAAFFAR1RAB9ANPC1
Toluene SCHEMBL10948410 0.85 MAPT (0.49) MAPTGAAFFAR1RAB9ANPC1
SCHEMBL8702369 0.85 MAPT (0.59) MAPTGAAFFAR1RAB9ANPC1
SCHEMBL9779998 0.85 MAPT (0.59) MAPTGAAFFAR1RAB9ANPC1
SCHEMBL809221 0.84 CA12 (0.56) MAPTKDM4ECA12CA1CA2
Hydrochloric Acid SCHEMBL10570595 0.83 NPC1 (0.70) MAPTGAARAB9ANPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113480485-B 1,2, 4-triaryl-1, 2, 4-triazoles compound and synthetic method thereof 甘肃农业大学 2023-04-07 CN claimed
CN-115521354-A Method for synthesizing polypeptide compound through carbon-hydrogen amination reaction catalyzed by visible light oxidation reduction 深圳市图微安创科技开发有限公司 2022-12-27 CN claimed
CN-105294413-B Method for preparing aldehyde/ketone by catalyzing alcohol oxidation with iron salt 浙江工业大学 2017-04-12 CN claimed
US-4868092-A SENSITIVE TO VISIBLE LIGHT, XANTHENE DYE INITIATOR NIPPON PAINT CO., LTD. (JP) 1989-09-19 US claimed
US-4533506-A Resolution of amino acids YEDA RESEARCH AND DEVELOPMENT COMPANY LTD. (IL) 1985-08-06 US claimed
CN-122081969-A VSe-Cu2-xSe nanosheet catalysis C (sp)3) -H bond CO2Method for directionally synthesizing alpha-hydroxy/amino acid by carboxylation 2026-05-26 CN disclosed
CN-115521354-B Method for synthesizing polypeptide compound by using visible light oxidation-reduction catalyzed carbon-hydrogen amination reaction 深圳市图微安创科技开发有限公司 2024-09-27 CN disclosed
CN-117843514-A Purification method of N-phenylglycine and derivatives thereof 维思普新材料(苏州)有限公司 2024-04-09 CN disclosed
EP-4217412-A1 WASTE MITIGATION METHODS AND MATERIALS Finite Research Ltd (GB) 2023-08-02 EP disclosed
WO-2023081764-A1 HEXADEPSIPEPTIDE COMPOUNDS AND METHODS OF USING THE SAME ZYMERGEN INC. (US) 2023-05-11 WO disclosed
CN-113480485-B 1,2, 4-triaryl-1, 2, 4-triazoles compound and synthetic method thereof 甘肃农业大学 2023-04-07 CN disclosed
CN-112812097-B Method for synthesizing 3- (2-pyridine) substituted pyrrole compound by visible light catalysis 河南师范大学(CN) 2023-01-13 CN disclosed
US-4189604-A PEPTIDASE ENZYME INHIBITORS ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1980-02-19 US disclosed
US-4094741-A CULTURES, ASYMMETRIC HYDROLYSIS KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JA) 1978-06-13 US disclosed
US-4065353-A Method for the preparation of D-carbamyl aminoacids and the corresponding D-aminoacids SNAMPROGETTI, S.P.A. (IT) 1977-12-27 US disclosed
US-4018759-A BACTERICIDES SMITHKLINE CORPORATION (US) 1977-04-19 US disclosed
US-RE29164-E BACTERICIDES BRISTOL-MYERS COMPANY (US) 1977-03-29 US disclosed
US-3957768-A BACTERICIDES SMITHKLINE CORPORATION (US) 1976-05-18 US disclosed
US-3946005-A BACTERICIDES SMITHKLINE CORPORATION (US) 1976-03-23 US disclosed
US-3943129-A BACTERICIDE SMITHKLINE CORPORATION (US) 1976-03-09 US disclosed