Benzoic Acid

Benzoic Acid

SCHEMBL983379

C=CCNCC=C.O=C(O)c1ccccc1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

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 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
DAO P14920 1/20 0.56
NAPRT Q6XQN6 1/20 0.56
KDM4E B2RXH2 3/20 0.55
ALDH1A1 P00352 4/20 0.54
HPGD P15428 2/20 0.54
LMNA P02545 1/20 0.54
POLB P06746 1/20 0.50
CES1 P23141 2/20 0.48
CES2 O00748 1/20 0.48
SRD5A2 P31213 1/20 0.48
MAPT P10636 2/20 0.47
HCAR3 P49019 1/20 0.47
AKT1 P31749 1/20 0.47
MAPK1 P28482 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
MEN1 O00255 1/20 0.45
CYP3A4 P08684 1/20 0.45
ALOX15 P16050 1/20 0.45
KMT2A Q03164 1/20 0.45

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
Benzophenone SCHEMBL7590791 0.88 ALDH1A1 (0.69) KDM4EALDH1A1HPGDLMNAPOLB
Acetophenone SCHEMBL7587242 0.85 KDM4E (0.53) KDM4EALDH1A1HPGDLMNAPOLB
Benzoyl Chloride SCHEMBL21084684 0.85 KDM4E (0.53) KDM4EALDH1A1HPGDLMNAPOLB
Phthalic Acid SCHEMBL11333396 0.84 ALDH1A1 (0.56) NAPRTKDM4EALDH1A1HPGDLMNA
SCHEMBL2521368 0.82 KDM4E (0.49) KDM4EALDH1A1HPGDLMNAPOLB
Benzoic Acid SCHEMBL3266320 0.81 TSHR (0.64) TSHRDAONAPRTKDM4EALDH1A1
SCHEMBL4413289 0.81 KDM4E (0.60) KDM4EALDH1A1HPGDLMNAPOLB
Benzoic Acid SCHEMBL971091 0.79 TSHR (0.61) TSHRDAONAPRTKDM4EALDH1A1
Benzoic Acid SCHEMBL9740671 0.79 TSHR (0.61) TSHRDAONAPRTKDM4EALDH1A1
Benzoic Acid SCHEMBL9472196 0.79 TSHR (0.61) TSHRDAONAPRTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2270110-B1 PIGMENT-DISPERSED COMPOSITION, COLORED PHOTOSENSITIVE COMPOSITION, PHOTOCURABLE COMPOSITION, COLOR FILTER, LIQUID CRYSTAL DISPLAY ELEMENT, AND SOLID IMAGE PICKUP ELEMENT FUJIFILM CORP (JP) 2015-02-25 EP disclosed
US-8362140-B2 Pigment-dispersed composition, colored photosensitive composition, photocurable composition, color filter, liquid crystal display device, and solid-state image pickup device FUJIFILM CORPORATION (JP) 2013-01-29 US disclosed
US-20110014401-A1 PIGMENT-DISPERSED COMPOSITION, COLORED PHOTOSENSITIVE COMPOSITION, PHOTOCURABLE COMPOSITION, COLOR FILTER, LIQUID CRYSTAL DISPLAY DEVICE, AND SOLID-STATE IMAGE PICKUP DEVICE FUJIFILM CORPORATION (JP) 2011-01-20 US disclosed
EP-2270110-A1 PIGMENT-DISPERSED COMPOSITION, COLORED PHOTOSENSITIVE COMPOSITION, PHOTOCURABLE COMPOSITION, COLOR FILTER, LIQUID CRYSTAL DISPLAY ELEMENT, AND SOLID IMAGE PICKUP ELEMENT FUJIFILM Corporation (JP) 2011-01-05 EP disclosed
US-6071983-A FOR TREATING TOOTH SURFACE BY FACILE HANDLING; FOR RESTORING A TOOTH-SURFACE WITH COATING MATERIAL OR RESTORING DENTAL RESTORATIVE RESINS SUN MEDICAL CO., LTD. (JP) 2000-06-06 US disclosed
US-5834532-A BLEND OF POLYMERIZABLE MONOMER HAVING ACIDIC GROUPS AND AN INITIATOR SUN MEDICAL CO., LTD. (JP) 1998-11-10 US disclosed
US-5730900-A Film and process for preparation of the same and liquid crystal display FUJI PHOTO FILM CO., LTD. (JP) 1998-03-24 US disclosed
US-5635105-A ANISOTROPIC LAYER HAS NEGATIVE BIREFRINGENCE AND COMPRISES POLYMER HAVING DISCOTIC STRUCTURE FUJI PHOTO FILM CO., LTD. (JP) 1997-06-03 US disclosed
US-5587406-A APPLYING CURABLE PRIMER COMPOSITION COMPRISING POLYMERIZABLE MONOMER HAVING ACID GROUP AND POLYMERIZABLE MONOMER HAVING HYDROXYL GROUP AND POLYMERIZATION INITIATOR TO TOOTH SUN MEDICAL CO., LTD. (JP) 1996-12-24 US disclosed
US-5530038-A CONTAINING UNSATURATED MONOMER WITH ACIDIC GROUP, UNSATURATED MONOMER WITH HYDROXYL GROUP, POLYMERIZATION INITIATOR, AMINE COMPOUND, ZIRCONIUM OXIDE AND ORGANIC COMPOSITE FILLERS SUN MEDICAL CO., LTD. (JP) 1996-06-25 US disclosed
US-4562278-A SUNSCREEN AGENTS DOW CORNING, LTD. (GB) 1985-12-31 US disclosed
EP-0138590-A2 Organosilicon compounds and preparation and use thereof Dow Corning Limited (GB) 1985-04-24 EP disclosed
US-4501767-A Multicoat forming method NIPPON PAINT CO., LTD. (JP) 1985-02-26 US disclosed