SCHEMBL9225477

SCHEMBL9225477

CCCCCCCCCCCCCCCCCC(=O)OC(OC(=O)CCCCCCCCCCCCCCCCC)c1ccc(OC(C)=O)c(OC(C)=O)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.51
TRPV1 Q8NER1 1/20 0.51
TOP2A P11388 2/20 0.45
LMNA P02545 3/20 0.44
LTA4H P09960 2/20 0.43
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
PTGS2 P35354 3/20 0.40
ALDH1A1 P00352 1/20 0.40
POLM Q9NP87 1/20 0.40
POLK Q9UBT6 1/20 0.40
POLL Q9UGP5 1/20 0.40
POLH Q9Y253 1/20 0.40
CNR1 P21554 2/20 0.39
CNR2 P34972 2/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39

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
SCHEMBL9218416 0.93 ALOX15 (0.58) ALOX15TRPV1TOP2ALMNAMAPT
SCHEMBL9220834 0.93 ALOX15 (0.58) ALOX15TRPV1TOP2ALMNAMAPT
SCHEMBL9223524 0.93 ALOX15 (0.58) ALOX15TRPV1TOP2ALMNAMAPT
SCHEMBL9226420 0.93 ALOX15 (0.58) ALOX15TRPV1TOP2ALMNAMAPT
SCHEMBL10350215 0.91 ALOX15 (0.55) ALOX15TRPV1TOP2ALMNALTA4H
SCHEMBL9223511 0.82 ALOX15 (0.56) ALOX15TOP2ALMNAALDH1A1
SCHEMBL15557746 0.80 ALOX15 (0.64) ALOX15TRPV1TOP2ALMNAMAPT
SCHEMBL15548722 0.80 ALOX15 (0.64) ALOX15TRPV1TOP2ALMNAMAPT
SCHEMBL9226980 0.79 ALDH1A1 (0.51) LMNAALDH1A1
SCHEMBL14535576 0.79 ALOX15 (0.53) ALOX15TRPV1TOP2ALMNALTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0147174-B1 DIHYDROXYBENZALDEHYDE DERIVATIVES AS ANTI-INFLAMMATORY AGENTS KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1990-06-27 EP claimed
US-4758591-A Dialkanoyloxybenzylidene dialkanoate KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-07-19 US claimed
EP-0147174-A2 Dihydroxybenzaldehyde derivatives as anti-inflammatory agents KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-07-03 EP claimed
EP-0395441-B1 Treating agent for osteoarthritis KUREHA CHEMICAL IND CO LTD (JP) 1995-02-15 EP disclosed
US-4997850-A Alcohol or ester KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-03-05 US disclosed
EP-0395441-A2 Treating agent for osteoarthritis KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1990-10-31 EP disclosed
EP-0147174-B1 DIHYDROXYBENZALDEHYDE DERIVATIVES AS ANTI-INFLAMMATORY AGENTS KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1990-06-27 EP disclosed
EP-0357092-A1 Preparation of diacetoxybenzylidene diacetates KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1990-03-07 EP disclosed
US-4841097-A REACTING DIHYDROXYBENZALDEHYDE WITH ALKANOIC ACID ANHYDRIDE KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1989-06-20 US disclosed
US-4758591-A Dialkanoyloxybenzylidene dialkanoate KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-07-19 US disclosed
EP-0147174-A2 Dihydroxybenzaldehyde derivatives as anti-inflammatory agents KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-07-03 EP disclosed