SCHEMBL9815752

SCHEMBL9815752

OC1(O)CCCC(C2CCCCC2)C1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
ATP1A1 P05023 4/20 0.33
ATP1B1 P05026 4/20 0.33
ATP1A3 P13637 4/20 0.33
ATP1B2 P14415 4/20 0.33
ATP1A2 P50993 4/20 0.33
ATP1B3 P54709 4/20 0.33
FXYD2 P54710 4/20 0.33
ATP1A4 Q13733 4/20 0.33
MAPT P10636 1/20 0.30
SLC18A3 Q16572 1/20 0.30
HSD11B1 P28845 1/20 0.30

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
SCHEMBL28497691 0.95 ALDH1A1 (0.40) ALDH1A1ATP1A1ATP1B1ATP1A3ATP1B2
SCHEMBL9815757 0.92 ALDH1A1 (0.32) ALDH1A1
SCHEMBL22209073 0.87 ALDH1A1 (0.42) ALDH1A1ATP1A1ATP1B1ATP1A3ATP1B2
SCHEMBL7551473 0.76 TRPA1 (0.43) ALDH1A1ATP1A1ATP1B1ATP1A3ATP1B2
SCHEMBL1005370 0.76 ALDH1A1 (0.47) ALDH1A1ATP1A1ATP1B1ATP1A3ATP1B2
SCHEMBL7922196 0.69 ALDH1A1 (0.37) ALDH1A1ATP1A1ATP1B1ATP1A3ATP1B2
SCHEMBL20134670 0.69
SCHEMBL29346455 0.68 ALDH1A1 (0.38) ALDH1A1
Biphenyl SCHEMBL8851247 0.67 ALDH1A1 (0.73) ALDH1A1MAPTSLC18A3HSD11B1
SCHEMBL7738712 0.67 ALDH1A1 (0.89) ALDH1A1MAPTSLC18A3HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111777642-B Halogen-free flame-retardant unsaturated polyester composition, polyester product, preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2020-12-11 CN disclosed
CN-111777642-A Halogen-free flame-retardant unsaturated polyester composition, polyester product, preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2020-10-16 CN disclosed
CN-105929642-A Electrophotographic photosensitive member, method for manufacturing electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus 佳能株式会社 2016-09-07 CN disclosed
EP-0197458-B1 CURABLE EPOXY RESIN COMPOSITION ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1991-11-06 EP disclosed
US-4689390-A AMINE-EPOXY ADDUCT REACTED WITH PHENOLIC RESIN, ONE-PACK ASAHI DENKA KOGYO K.K. (JP) 1987-08-25 US disclosed
US-4657947-A COVERING RUSTY METAL SURFACES ASAHI DENKA KOGYO K.K. (JP) 1987-04-14 US disclosed
US-4657953-A CORROSION RESISTANCE ASAHI DENKA KOGYO K.K. (JP) 1987-04-14 US disclosed
EP-0197458-A2 Curable epoxy resin composition ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1986-10-15 EP disclosed
US-4535103-A POLYEPOXIDES AND EPOXY RESINS CROSSLINKED AND HARDENED WITH PHOSPHOROUS COMPOUNDS, AMINES, AND DIISOCYANATES ASAHI DENKA KOGYO K.K. (JP) 1985-08-13 US disclosed
US-4530947-A A RUSTY METAL-ADHERING CURABLE MIXTURE OF EPOXIDE-POLYHYDROXIDE REACTION PRODUCT, POLYISOCYANATE AND BITUMINOUS MATERIAL ASAHI DENKA KOGYO K.K. (JP) 1985-07-23 US disclosed
US-4340716-A EPOXY RESINS AND HARDENERS ASAHI DENKA KOGYO K.K. (JP) 1982-07-20 US disclosed
US-3950451-A COUPLED PRODUCT OF ALKYLPHENOL AND PHENOL-FORMALDEHYDE-DIAMINE CONDENSATE ASAHI DENKA KOGYO K.K. (JA) 1976-04-13 US disclosed