SCHEMBL543714

SCHEMBL543714

CCCCOc1ccccc1[S]

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.60
CYP2C19 P33261 3/20 0.60
CYP2C9 P11712 2/20 0.60
LTA4H P09960 2/20 0.47
L3MBTL1 Q9Y468 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
CYP19A1 P11511 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 2/20 0.45
MAPT P10636 2/20 0.45
MEN1 O00255 1/20 0.45
NR1I2 O75469 1/20 0.45
LMNA P02545 1/20 0.45
CHRM2 P08172 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADRA2A P08913 1/20 0.45
OPRK1 P41145 1/20 0.45
HTR2B P41595 1/20 0.45
SLC6A3 Q01959 1/20 0.45
HDAC6 Q9UBN7 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
SCHEMBL6003210 0.94 CYP1A2 (0.53) CYP1A2CYP2C19CYP2C9LTA4HL3MBTL1
SCHEMBL5649591 0.92 LMNA (0.54) CYP1A2CYP2C19CYP2C9LTA4HL3MBTL1
SCHEMBL1402312 0.92 LMNA (0.54) CYP1A2CYP2C19CYP2C9LTA4HL3MBTL1
SCHEMBL1402386 0.92 LMNA (0.54) CYP1A2CYP2C19CYP2C9LTA4HL3MBTL1
SCHEMBL1402282 0.89 CYP1A2 (0.47) CYP1A2CYP2C19CYP2C9L3MBTL1TDP1
1,2-Dibutoxybenzene SCHEMBL1226749 0.84 CYP1A2 (0.72) CYP1A2CYP2C19CYP2C9LTA4HL3MBTL1
1,2-Dibutoxybenzene SCHEMBL29428927 0.84 CYP1A2 (0.72) CYP1A2CYP2C19CYP2C9LTA4HL3MBTL1
1,2-Dibutoxybenzene SCHEMBL6236324 0.82 CYP1A2 (0.69) CYP1A2CYP2C19CYP2C9LTA4HL3MBTL1
SCHEMBL1402570 0.80 ALDH1A1 (0.56) CYP1A2CYP2C19L3MBTL1TDP1GAA
1-Propoxy-2-Butoxybenzene SCHEMBL2846696 0.80 CYP1A2 (0.67) CYP1A2CYP2C19CYP2C9LTA4HL3MBTL1

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 239 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0170164-B1 SILVER HALIDE COLOR PHOTOGRAPHIC LIGHT-SENSITIVE MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1988-10-05 EP claimed
US-H122-H PYRAZOLOAZOLE-TYPE MAGENTA COUPLER DISPERSED IN A HIGH-BOILING PHOSPHATE SOLVENT FUJI PHOTO FILM CO., LTD. (JP) 1986-09-02 US claimed
EP-0170164-A2 Silver halide color photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1986-02-05 EP claimed
EP-2123695-B1 METAL THIETANE COMPOUND, POLYMERIZABLE COMPOSITION COMPRISING THE COMPOUND, RESIN, AND USE OF THE RESIN MITSUI CHEMICALS INC (JP) 2021-06-23 EP disclosed
US-10190009-B2 Ink composition, ink jet recording method using same, and colored material NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2019-01-29 US disclosed
EP-2314637-B1 COMPOSITION, POLYMERIZABLE COMPOSITION, RESIN, OPTICAL COMPONENT, AND PRODUCTION METHOD OF COMPOSITION MITSUI CHEMICALS INC (JP) 2017-07-12 EP disclosed
EP-2230271-B1 ADDITIVE FOR POLYMERIZABLE COMPOSITION, POLYMERIZABLE COMPOSITION CONTAINING THE SAME, AND USE OF THE POLYMERIZABLE COMPOSITION MITSUI CHEMICALS INC (JP) 2016-09-07 EP disclosed
US-20160160065-A1 INK COMPOSITION, INK JET RECORDING METHOD USING SAME, AND COLORED MATERIAL NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2016-06-09 US disclosed
EP-3015516-A1 INK COMPOSITION, INK JET RECORDING METHOD USING SAME, AND COLORED MATERIAL Nippon Kayaku Kabushiki Kaisha (JP) 2016-05-04 EP disclosed
EP-2354187-B1 DISPERSED COMPOSITION, POLYMERIZABLE COMPOSITION, LIGHT SHIELDING COLOR FILTER, SOLID-STATE IMAGING ELEMENT, LIQUID CRYSTAL DISPLAY DEVICE, WAFER-LEVEL LENS, AND IMAGING UNIT FUJIFILM CORP (JP) 2016-03-02 EP disclosed
EP-2982706-A1 ADDITIVE FOR POLYMERIZABLE COMPOSITION, POLYMERIZABLE COMPOSITION CONTAINING THE SAME, AND USE OF THE POLYMERIZABLE COMPOSITION Mitsui Chemicals, Inc. (JP) 2016-02-10 EP disclosed
US-4590153-A CONTAINING MAGENTA COUPLER AND METAL COMPLEX FUJI PHOTO FILM CO., LTD. (JP) 1986-05-20 US disclosed
EP-0177765-A1 Silver halide color photographic material FUJI PHOTO FILM CO., LTD. (JP) 1986-04-16 EP disclosed
EP-0176804-A1 Silver halide color photograhic materials FUJI PHOTO FILM CO., LTD. (JP) 1986-04-09 EP disclosed
EP-0175573-A2 Light-sensitive silver halide color photographic material KONICA CORPORATION (JP) 1986-03-26 EP disclosed
EP-0170164-A2 Silver halide color photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1986-02-05 EP disclosed
US-4559297-A DISCOLORATION INHIBITION FUJI PHOTO FILM CO., LTD. (JP) 1985-12-17 US disclosed
EP-0164130-A2 Silver halide color photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1985-12-11 EP disclosed
US-4300942-A N-(Substituted carbonyl) derivatives of N-phos-phinylmethylglycinates and the herbicidal use thereof MONSANTO COMPANY (US) 1981-11-17 US disclosed
US-4251258-A N-(Substituted carbonyl) derivatives of N-phosphinylmethylglycinates and the herbicidal use thereof MONSANTO COMPANY (US) 1981-02-17 US disclosed