SCHEMBL8846153

SCHEMBL8846153

CC=C(CC)Oc1ccc(C=O)cc1OC(=CC)CC

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.49
TSHR P16473 1/20 0.49
FDPS P14324 1/20 0.46
AOX1 Q06278 1/20 0.45
TRIM24 O15164 1/20 0.45
HPGD P15428 1/20 0.45
ALDH5A1 P51649 1/20 0.45
ABAT P80404 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
TRIM33 Q9UPN9 1/20 0.45
MAPT P10636 2/20 0.43
KDM4E B2RXH2 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TACR2 P21452 1/20 0.40

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
SCHEMBL11032181 0.77 KMT2A (0.51) ALDH1A1HPGDALDH5A1ABATMAPT
SCHEMBL7272198 0.75 ALDH1A1 (0.51) ALDH1A1TSHRFDPSAOX1TRIM24
SCHEMBL320559 0.75 JUN (0.57) ALDH1A1TSHRFDPSAOX1TRIM24
SCHEMBL31190039 0.75 JUN (0.57) ALDH1A1TSHRFDPSAOX1TRIM24
SCHEMBL8846494 0.75 ALOX15 (0.44) HTT
SCHEMBL891572 0.74 FGFR1 (0.65) ALDH1A1TSHRFDPSAOX1TRIM24
SCHEMBL5784373 0.73 ALDH1A1 (0.60) ALDH1A1TSHRFDPSHPGDTDP1
SCHEMBL7195683 0.73 ALDH1A1 (0.52) ALDH1A1TSHRFDPSAOX1TRIM24
SCHEMBL7665789 0.72 ALDH1A1 (0.67) ALDH1A1TSHRFDPSAOX1TRIM24
SCHEMBL11010952 0.72 ALDH1A1 (0.53) ALDH1A1TSHRTRIM24HPGDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0664282-B1 Biaryl phospholipase A2 inhibitors BRISTOL MYERS SQUIBB CO (US) 1997-10-22 EP disclosed
EP-0664282-A1 Biaryl phospholipase A2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 1995-07-26 EP disclosed