SCHEMBL7768640

SCHEMBL7768640

C=Cc1ccccc1COCCCO

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TEAD3 Q99594 1/20 0.33
GBA1 P04062 2/20 0.31
LCT P09848 2/20 0.31
SI P14410 2/20 0.31
UGCG Q16739 2/20 0.31
GBA2 Q9HCG7 2/20 0.31
MGAM O43451 1/20 0.31
PTPN1 P18031 1/20 0.30
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
ADRB3 P13945 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
SCHEMBL7768631 0.95 GBA1 (0.33) ALDH1A1TEAD3GBA1LCTSI
SCHEMBL9193381 0.88 ALDH1A1 (0.36) ALDH1A1TEAD3GBA1LCTSI
SCHEMBL9193908 0.88 ALDH1A1 (0.36) ALDH1A1TEAD3GBA1LCTSI
SCHEMBL8758480 0.83 ALDH1A1 (0.33) ALDH1A1TEAD3
SCHEMBL759640 0.83 ALDH1A1 (0.40) ALDH1A1
SCHEMBL9544583 0.83 L3MBTL1 (0.35) ALDH1A1TEAD3GBA1LCTSI
SCHEMBL7768663 0.83 ALDH1A1 (0.33) ALDH1A1TEAD3
SCHEMBL3959527 0.82 ALDH1A1 (0.32) ALDH1A1
SCHEMBL4895132 0.82 THRA (0.38) ALDH1A1
SCHEMBL3371484 0.82 ALDH1A1 (0.32) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6316177-B1 COLOR SILVER HALIDE PHOTOGRAPHIC ELEMENT OR NONSILVER LIGHT INSENSITIVE LAYER WITH HETEROCYCLIC POLYMER EASTMAN KODAK COMPANY 2001-11-13 US disclosed
EP-1143291-A2 Color photographic element containing speed-improving polymer EASTMAN KODAK COMPANY (US) 2001-10-10 EP disclosed
EP-0670184-B1 Method of demineralizing water or an aqueous solution MITSUBISHI CHEM CORP (JP) 2001-09-05 EP disclosed
US-5518627-A DEMINERALIZATION, BASIC ANION EXCHANGE RESIN MITSUBISHI CHEMICAL CORPORATION (JP) 1996-05-21 US disclosed
EP-0670184-A2 Method of demineralizing water or an aqueous solution Mitsubishi Chemical Corporation (JP) 1995-09-06 EP disclosed