Methyl Benzoate

Methyl Benzoate

SCHEMBL19206967

COC(=O)c1ccccc1.Cc1cccc(C)c1

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.73
TDP1 Q9NUW8 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.58
RAB9A P51151 3/20 0.56
GPR17 Q13304 1/20 0.54
MAPT P10636 3/20 0.53
CASP3 P42574 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
POLB P06746 2/20 0.51
KCNK3 O14649 1/20 0.51
KCNK9 Q9NPC2 1/20 0.51
LOXL2 Q9Y4K0 1/20 0.50
CTDSP1 Q9GZU7 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
Methyl Benzoate SCHEMBL19206944 0.92 TSHR (0.79) TSHRTDP1SMN1; SMN2RAB9AMAPT
Methyl Benzoate SCHEMBL28187000 0.91 TSHR (0.66) TSHRTDP1SMN1; SMN2RAB9AGPR17
Methyl Benzoate SCHEMBL16041278 0.90 TSHR (0.83) TSHRTDP1SMN1; SMN2RAB9AMAPT
Methyl 3,5-Dimethylbenzoate SCHEMBL9579696 0.89 TSHR (0.73) TSHRTDP1SMN1; SMN2RAB9AMAPT
Toluene SCHEMBL28306821 0.89 TSHR (0.67) TSHRTDP1SMN1; SMN2RAB9AGPR17
SCHEMBL29534771 0.88 GPR17 (0.65) TSHRTDP1SMN1; SMN2RAB9AGPR17
SCHEMBL28289702 0.88 GPR17 (0.65) TSHRTDP1SMN1; SMN2RAB9AGPR17
SCHEMBL40429 0.88 GPR17 (0.65) TSHRTDP1SMN1; SMN2RAB9AGPR17
Methyl Benzoate SCHEMBL28005847 0.88 TSHR (0.79) TSHRTDP1SMN1; SMN2RAB9AMAPT
Methyl Benzoate SCHEMBL19206945 0.86 TSHR (0.83) TSHRTDP1SMN1; SMN2RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3496174-B1 INK COMPOSITION AND PHOTOELECTRIC CONVERSION ELEMENT PRODUCED USING SAME SUMITOMO CHEMICAL CO (JP) 2024-06-12 EP disclosed
CN-107109090-B Ink composition and photoelectric conversion element produced using same 住友化学株式会社 2021-10-08 CN disclosed
EP-3496174-A1 INK COMPOSITION AND PHOTOELECTRIC CONVERSION ELEMENT PRODUCED USING SAME Sumitomo Chemical Company, Ltd. (JP) 2019-06-12 EP disclosed
EP-3219765-B1 INK COMPOSITION AND PHOTOELECTRIC CONVERSION ELEMENT PRODUCED USING SAME SUMITOMO CHEMICAL CO (JP) 2019-01-30 EP disclosed
EP-3219765-A1 INK COMPOSITION AND PHOTOELECTRIC CONVERSION ELEMENT PRODUCED USING SAME Sumitomo Chemical Company, Ltd. (JP) 2017-09-20 EP disclosed
US-20170237012-A1 INK COMPOSITION AND PHOTOELECTRIC CONVERSION DEVICE PRODUCED USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-17 US disclosed