SCHEMBL29959614

SCHEMBL29959614

COc1cccc(C(=O)O)c1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.59
CA12 O43570 1/20 0.59
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CA7 P43166 1/20 0.59
CA9 Q16790 1/20 0.59
CA14 Q9ULX7 1/20 0.59
KDM4E B2RXH2 5/20 0.56
HPGD P15428 5/20 0.56
ALDH1A1 P00352 4/20 0.56
TSHR P16473 3/20 0.56
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
POLB P06746 1/20 0.56
GAA P10253 1/20 0.56
MAPT P10636 1/20 0.56
RECQL P46063 1/20 0.56
MCL1 Q07820 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56

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
SCHEMBL311839 1.00 HTT (0.59) HTTCA12CA1CA2CA7
SCHEMBL28837856 0.98 HTT (0.58) HTTCA12CA1CA2CA7
Hydrochloric Acid SCHEMBL2375636 0.98 HTT (0.58) HTTCA12CA1CA2CA7
Benzoic Acid SCHEMBL30951647 0.86 CA2 (0.50) HTTCA12CA1CA2CA7
SCHEMBL28649390 0.84 TSHR (0.50) HTTCA12CA1CA2CA7
SCHEMBL28616881 0.84 TSHR (0.50) HTTCA12CA1CA2CA7
SCHEMBL698393 0.84 LMNA (0.53) HTTCA12CA1CA2CA7
SCHEMBL9102841 0.84 PTGER1 (0.49) HTTCA12CA1CA2CA7
SCHEMBL3796962 0.82 GAA (0.54) HTTKDM4EALDH1A1TSHRGAA
SCHEMBL8423142 0.82 UTS2R (0.47) HTTCA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-221564170-U Be used for stable strorage device of 2-methyl-3-methoxy benzoic acid 徐州彰梁生化科技有限公司 2024-08-20 CN disclosed
CN-114369019-B Preparation method of 2-methyl-3-methoxybenzoic acid 山东友道化学有限公司 2024-07-26 CN disclosed
CN-115279206-A Flavor composition 弗门尼舍有限公司 2022-11-01 CN disclosed
WO-2022222272-A1 SYNTHESIS PROCESS OF 2-METHYL-3-METHOXYBENZOIC ACID 江苏永安化工有限公司 2022-10-27 WO disclosed
WO-2022222272-A1 SYNTHESIS PROCESS OF 2-METHYL-3-METHOXYBENZOIC ACID 江苏永安化工有限公司 2022-10-27 WO disclosed