Benzoic Acid

Benzoic Acid

SCHEMBL2854052

CC(C)[O-].O=C([O-])c1ccccc1.O=C([O-])c1ccccc1.[Al+3]

nearest known ligand 0.70

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Known targets — ChEMBL curated mechanism

CACNA1CCACNA1DCACNA1FCACNA1SDPP4HTR1BHTR1D

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

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.70
CA4 P22748 1/20 0.70
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
XBP1 P17861 1/20 0.45
ATM Q13315 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CES2 O00748 4/20 0.44
CES1 P23141 4/20 0.44
TSHR P16473 2/20 0.44
DAO P14920 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
ALDH1A1 P00352 1/20 0.44
USP2 O75604 1/20 0.44
CA1 P00915 8/20 0.43

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
Benzoic Acid SCHEMBL1033231 0.91 CA2 (0.76) CA2CA4LMNAMAPTXBP1
Benzoic Acid SCHEMBL1535463 0.88 CA2 (0.89) CA2CA4LMNAMAPTSMN1; SMN2
Benzoic Acid SCHEMBL115644 0.88 CA2 (0.89) CA2CA4LMNAMAPTSMN1; SMN2
Benzoic Acid SCHEMBL7210053 0.87 CA2 (0.64) CA2CA4LMNAMAPTXBP1
Benzoic Acid SCHEMBL29019191 0.86 CA2 (0.70) CA2CA4LMNAMAPTXBP1
Benzoic Acid SCHEMBL31683009 0.86 CA2 (0.70) CA2CA4LMNAMAPTXBP1
Benzoic Acid SCHEMBL11054341 0.86 CA2 (0.76) CA2CA4CES2CES1TSHR
Benzoic Acid SCHEMBL11652817 0.85 CA2 (0.84) CA2CA4LMNAMAPTSMN1; SMN2
Benzoic Acid SCHEMBL11441689 0.85 CA2 (0.84) CA2CA4MAPTSMN1; SMN2CES2
Benzoic Acid SCHEMBL28569088 0.85 CA2 (0.84) CA2CA4LMNAMAPTSMN1; 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1179569-B1 Silicone composition and electrically conductive cured silicone product DOW CORNING (US) 2010-01-13 EP disclosed
US-6831145-B2 Used in manufacture of electronic, construction, appliance, and aerospace products; coating, adhesive, or gasket DOW CORNING CORPORATION 2004-12-14 US disclosed
US-20030008955-A1 Silicone composition and electrically conductive, cured silicone product DOLBY LABORATORIES LICENSING CORPORATION 2003-01-09 US disclosed
US-6465550-B1 POLYSILOXANE WITH TERMINAL EPOXY FUNCTIONAL GROUPS, PHENOL FREE CURING AGENT, FILLER OF SUCH AS SILVER, GOLD, PLATINUM AND/OR PALLADIUM AND HYROXYLATED COMPOUND; ELECTRONICS, CONSTRUCTION MATERIALS, APPLIANCES, AEROSPACE DOW CORNING CORPORATION 2002-10-15 US disclosed
EP-1179569-A2 Silicone composition and electrically conductive cured silicone product DOW CORNING CORPORATION (US) 2002-02-13 EP disclosed
US-RE31543-E EPOXIDE, SILOXANE, ALUMINUM CATALYST DOW CORNING CORPORATION (US) 1984-03-27 US disclosed
US-4202811-A USED TO ENCAPSULATE ELECTRONIC DEVICES DOW CORNING CORPORATION (US) 1980-05-13 US disclosed
US-4082719-A ORGANOSILICON AND ALUMINUM COMPOUNDS, CURING CATALYST DOW CORNING CORPORATION (US) 1978-04-04 US disclosed
US-3971747-A ORGANO-SILICON, EPOXIDE, ALUMINUM CONTAINING CATALYST DOW CORNING CORPORATION (US) 1976-07-27 US disclosed