SCHEMBL9999775

SCHEMBL9999775

CCCCCCOC(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.53
CYP3A4 P08684 1/20 0.53
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
LMNA P02545 3/20 0.49
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TSHR P16473 2/20 0.48
TP53 P04637 1/20 0.48
GAA P10253 1/20 0.47
PLA2G4B P0C869 1/20 0.47
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
ASAH1 Q13510 1/20 0.45
RARB P10826 3/20 0.44

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
SCHEMBL10883532 1.00 ALDH1A1 (0.53) ALDH1A1CYP3A4NPC1RAB9ASMN1; SMN2
SCHEMBL715224 1.00 ALDH1A1 (0.53) ALDH1A1CYP3A4NPC1RAB9ASMN1; SMN2
SCHEMBL9999772 1.00 ALDH1A1 (0.53) ALDH1A1CYP3A4NPC1RAB9ASMN1; SMN2
SCHEMBL16070465 1.00 ALDH1A1 (0.53) ALDH1A1CYP3A4NPC1RAB9ASMN1; SMN2
SCHEMBL9999771 1.00 ALDH1A1 (0.53) ALDH1A1CYP3A4NPC1RAB9ASMN1; SMN2
SCHEMBL2754343 0.98 CYP3A4 (0.54) ALDH1A1CYP3A4NPC1RAB9ASMN1; SMN2
SCHEMBL50248 0.94 ALDH1A1 (0.55) ALDH1A1CYP3A4NPC1RAB9ASMN1; SMN2
SCHEMBL9004714 0.92 ALDH1A1 (0.48) ALDH1A1CYP3A4NPC1RAB9ASMN1; SMN2
Alcohol SCHEMBL28674564 0.91 ALDH1A1 (0.53) ALDH1A1CYP3A4NPC1RAB9ASMN1; SMN2
SCHEMBL11604573 0.91 CYP3A4 (0.57) ALDH1A1CYP3A4NPC1RAB9ASMN1; 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
CN-109265328-B Method for green synthesis of benzoin diether driven by visible light 兰州大学 2021-06-04 CN disclosed
US-20120033167-A1 LIQUID CRYSTAL DISPLAY DEVICE, METHOD FOR MANUFACTURING LIQUID CRYSTAL DISPLAY DEVICE, COMPOSITION FOR FORMING POLYMER LAYER, AND COMPOSITION FOR FORMING LIQUID CRYSTAL LAYER SHARP KABUSHIKI KAISHA (JP) 2012-02-09 US disclosed
EP-0005379-B2 PHOTOSENSITIVE COMPOSITIONS CONTAINING CARBONYLIC HALIDES AS ACTIVATORS Dynachem Corporation (US) 1986-06-04 EP disclosed
US-4552830-A UNSATURATED COMPOUND, FREE RADICAL-PRODUCING PHOTOINITIATOR FLUORA COLOR FORMER, PROTON DONOR DYNACHEM CORPORATION (US) 1985-11-12 US disclosed
US-4343885-A PHOTORESISTS DYNACHEM CORPORATION (US) 1982-08-10 US disclosed
EP-0005380-B1 PHOTOTROPIC PHOTOSENSITIVE COMPOSITIONS CONTAINING A FLUORAN COLORFORMER Dynachem Corporation (US) 1982-01-06 EP disclosed
EP-0005379-B1 PHOTOSENSITIVE COMPOSITIONS CONTAINING CARBONYLIC HALIDES AS ACTIVATORS Dynachem Corporation (US) 1981-12-23 EP disclosed
EP-0005379-A2 Photosensitive compositions containing carbonylic halides as activators Dynachem Corporation (US) 1979-11-14 EP disclosed
US-3937722-A PHOTOSENSITIZERS, IRRADIATION POLYMERIZATION, CROSSLINKING BAYER AG (DT) 1976-02-10 US disclosed