Benzoyl Formic Acid

Benzoyl Formic Acid

SCHEMBL16044962

CC(C)(O)CCCC(C)(C)O.O=C(O)C(=O)c1ccccc1.O=C(O)c1ccccc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CACNA1CCACNA1DCACNA1FCACNA1SDPP4HTR1BHTR1D

The experimentally established mechanism targets of Benzoyl Formic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 10/20 0.50
CES1 P23141 10/20 0.50
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.49
APEX1 P27695 1/20 0.49
KMT2A Q03164 1/20 0.49
CTDSP1 Q9GZU7 1/20 0.49
DAO P14920 1/20 0.47
TSHR P16473 1/20 0.47
NAPRT Q6XQN6 1/20 0.47
SRD5A2 P31213 1/20 0.41
PTPRC P08575 1/20 0.38
PTPN1 P18031 1/20 0.38
CPT1B Q92523 1/20 0.37
CYP2C19 P33261 1/20 0.37
HIF1A Q16665 1/20 0.37
EGFR P00533 1/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36

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
Benzoyl Formic Acid SCHEMBL16047998 0.93 CES2 (0.53) CES2CES1MEN1POLBAPEX1
Benzoic Acid SCHEMBL1784044 0.91 TSHR (0.56) CES2CES1MEN1POLBAPEX1
Benzoyl Formic Acid SCHEMBL28682667 0.91 CES2 (0.44) CES2CES1MEN1POLBAPEX1
Benzoyl Formic Acid SCHEMBL28686042 0.89 CES2 (0.48) CES2CES1MEN1POLBAPEX1
Benzoic Acid SCHEMBL3683174 0.84 TSHR (0.61) CES2CES1MEN1POLBAPEX1
Benzoic Acid SCHEMBL16044755 0.83 MEN1 (0.44) CES2CES1MEN1POLBAPEX1
Benzoic Acid SCHEMBL27545709 0.81 TSHR (0.48) CES2CES1MEN1POLBAPEX1
Benzoic Acid SCHEMBL16048080 0.81 TSHR (0.50) CES2CES1MEN1POLBAPEX1
Benzoic Acid SCHEMBL29415241 0.81 POLB (0.47) CES2CES1MEN1POLBAPEX1
Benzoic Acid SCHEMBL28406157 0.80 DAO (0.47) CES2CES1MEN1POLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109180843-B Non-phthalate compounds as electron donors for polyolefin catalysts 美国台塑公司 2022-03-01 CN claimed
EP-2969201-B1 NON-PHTHALATE COMPOUNDS AS ELECTRON DONORS FOR POLYOLEFIN CATALYSTS FORMOSA PLASTICS CORP USA (US) 2022-05-04 EP disclosed
CN-109180843-B Non-phthalate compounds as electron donors for polyolefin catalysts 美国台塑公司 2022-03-01 CN disclosed
US-9790291-B2 Non-phthalate compounds as electron donors for polyolefin catalysts FORMOSA PLASTICS CORPORATION, USA (US) 2017-10-17 US disclosed
EP-2969201-A2 NON-PHTHALATE COMPOUNDS AS ELECTRON DONORS FOR POLYOLEFIN CATALYSTS Formosa Plastics Corporation, U.S.A. (US) 2016-01-20 EP disclosed
WO-2014160012-A2 NON-PHTHALATE COMPOUNDS AS ELECTRON DONORS FOR POLYOLEFIN CATALYSTS FORMOSA PLASTICS CORPORATION, USA (US) 2014-10-02 WO disclosed
US-20140275456-A1 NON-PHTHALATE COMPOUNDS AS ELECTRON DONORS FOR POLYOLEFIN CATALYSTS FORMOSA PLASTICS CORPORATION, USA (US) 2014-09-18 US disclosed