SCHEMBL7822299

SCHEMBL7822299

NC(=O)c1ccccc1-c1ccccc1C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.69
MYC P01106 1/20 0.57
ALDH1A1 P00352 5/20 0.56
ALOX15 P16050 1/20 0.56
CYP3A4 P08684 1/20 0.55
CYP2C9 P11712 1/20 0.55
ALOX12 P18054 1/20 0.55
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
KDM4E B2RXH2 2/20 0.52
HPGD P15428 2/20 0.52
MAPT P10636 1/20 0.52
TSHR P16473 1/20 0.52
HSD17B10 Q99714 1/20 0.52
GAA P10253 1/20 0.52
FOLH1 Q04609 2/20 0.50
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
CSNK1A1 P48729 1/20 0.49

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
SCHEMBL27659760 1.00 BCAT2 (0.69) BCAT2MYCALDH1A1ALOX15CYP3A4
SCHEMBL210767 0.91 BCAT2 (0.74) BCAT2ALDH1A1CYP3A4NPC1RAB9A
SCHEMBL30514077 0.91 BCAT2 (0.74) BCAT2ALDH1A1CYP3A4NPC1RAB9A
Hydrochloric Acid SCHEMBL16463881 0.88 BCAT2 (0.71) BCAT2ALDH1A1CYP3A4NPC1RAB9A
SCHEMBL31012518 0.88 BCAT2 (0.71) BCAT2ALDH1A1CYP3A4NPC1RAB9A
SCHEMBL1110181 0.88 BCAT2 (0.71) BCAT2ALDH1A1CYP3A4NPC1RAB9A
SCHEMBL36145 0.88 ALDH1A1 (0.72) MYCALDH1A1ALOX15CYP3A4CYP2C9
SCHEMBL30028907 0.88 ALDH1A1 (0.72) MYCALDH1A1ALOX15CYP3A4CYP2C9
SCHEMBL25148825 0.86 BCAT2 (0.53) BCAT2MYCALDH1A1ALOX15CYP3A4
Hydrochloric Acid SCHEMBL7579852 0.85 ALDH1A1 (0.68) MYCALDH1A1ALOX15CYP3A4CYP2C9

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
WO-2023062627-A1 HERBICIDES AND USE THEREOF PROJINI AGCHEM LTD (IL) 2023-04-20 WO disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
US-6160194-A Soil decontamination using ferric chelates and peroxide THE CONNECTICUT AGRICULTURAL EXPERIMENT STATION (US) 2000-12-12 US disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO disclosed
US-5580702-A COMPRISING A PHOTOSENSITIVE ACID-GENERATING COMPOUND AND A COPOLYMER OF P-HYDROXYSTYRENE AND AN ESTER OF P-CARBOXYMETHOXYSTYRENE; NONTOXIC; STEEP WALLS; HIGH SPEED; SEMICONDUCTORS KABUSHIKI KAISHA TOSHIBA (JP) 1996-12-03 US disclosed
US-5403695-A Photolithography; high resolution; semiconductors KABUSHIKI KAISHA TOSHIBA (JP) 1995-04-04 US disclosed
US-5232484-A Aqueous acid solution; mineralization; absence of large concentrations of organic solvents, chloride and sulfate THE CONNECTICUT AGRICULTURAL EXPERIMENT STATION (US) 1993-08-03 US disclosed