SCHEMBL10350549

SCHEMBL10350549

CCCCCCCCCCCCCCCC(=O)Oc1ccc(C(CCCCCCCCCCCCCCCC(=O)O)CCCCCCCCCCCCCCCC(=O)O)cc1OC(=O)CCCCCCCCCCCCCCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.53
TOP2A P11388 2/20 0.49
FFAR4 Q5NUL3 2/20 0.46
FFAR1 O14842 2/20 0.46
LTB4R Q15722 1/20 0.45
CYSLTR2 Q9NS75 1/20 0.43
CYSLTR1 Q9Y271 1/20 0.43
AKR1C3 P42330 1/20 0.43
AKR1C2 P52895 1/20 0.43
GPR84 Q9NQS5 7/20 0.42
PPARG P37231 6/20 0.42
PPARD Q03181 6/20 0.42
PPARA Q07869 6/20 0.42
HDAC11 Q96DB2 5/20 0.42
TSHR P16473 4/20 0.42
ALDH1A1 P00352 2/20 0.42
TLR2 O60603 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
FABP4 P15090 2/20 0.42
PTPN1 P18031 2/20 0.42

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
SCHEMBL10350499 1.00 ALOX15 (0.53) ALOX15TOP2AFFAR4FFAR1LTB4R
SCHEMBL10350510 1.00 ALOX15 (0.53) ALOX15TOP2AFFAR4FFAR1LTB4R
SCHEMBL10351042 1.00 ALOX15 (0.53) ALOX15TOP2AFFAR4FFAR1LTB4R
SCHEMBL10350216 0.87 ALOX15 (0.55) ALOX15TOP2AAKR1C3AKR1C2TSHR
SCHEMBL10350478 0.86 PTGS2 (0.46) ALOX15LTB4RTSHRALDH1A1
SCHEMBL23317915 0.84 LTB4R (0.43) ALOX15TOP2AFFAR4FFAR1LTB4R
SCHEMBL15557746 0.81 ALOX15 (0.64) ALOX15TOP2AAKR1C3AKR1C2MEN1
SCHEMBL15548722 0.81 ALOX15 (0.64) ALOX15TOP2AAKR1C3AKR1C2MEN1
SCHEMBL10351286 0.81 CYSLTR2 (0.47) ALOX15TOP2AFFAR4FFAR1CYSLTR2
SCHEMBL10350426 0.81 CYSLTR2 (0.47) ALOX15TOP2AFFAR4FFAR1CYSLTR2

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 1 patent. 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