SCHEMBL10735212

SCHEMBL10735212

C=C(C)C(=O)Oc1cccc2ccccc12.C=C(C)C(=O)Oc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.55
▸ ALDH1A1 P00352 5/20 0.53
▸ HSD17B10 Q99714 3/20 0.53
▸ PGR P06401 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ PTGS1 P23219 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ KDM4E B2RXH2 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ HPGD P15428 2/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ FABP3 P05413 6/20 0.45
▸ FABP7 O15540 5/20 0.45
▸ FABP5 Q01469 4/20 0.45
▸ MAPT P10636 2/20 0.43
▸ KCNA3 P22001 1/20 0.43
▸ HTT P42858 1/20 0.43

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
SCHEMBL67480 0.92 ALDH1A1 (0.60) ELANEALDH1A1HSD17B10PGRGAA
SCHEMBL29373404 0.92 ALDH1A1 (0.60) ELANEALDH1A1HSD17B10PGRGAA
Methacrylic Acid SCHEMBL3165127 0.91 ALDH1A1 (0.55) ELANEALDH1A1HSD17B10PGRGAA
SCHEMBL5082537 0.89 ALDH1A1 (0.56) ALDH1A1HSD17B10PGRGAAPTGS1
Isobutane SCHEMBL28204777 0.88 ALDH1A1 (0.55) ELANEALDH1A1HSD17B10PGRGAA
Acrylic Acid SCHEMBL28215232 0.87 ALDH1A1 (0.51) ELANEALDH1A1HSD17B10PGRGAA
Sulfuric Acid SCHEMBL3802923 0.86 ALDH1A1 (0.54) ELANEALDH1A1HSD17B10PGRGAA
Methacrylic Acid SCHEMBL28092937 0.85 ALDH1A1 (0.54) ELANEALDH1A1HSD17B10PGRGAA
SCHEMBL15058 0.83 ELANE (0.73) ELANEALDH1A1HSD17B10GAAKDM4E
SCHEMBL87437 0.83 ELANE (0.73) ELANEALDH1A1HSD17B10GAAKDM4E

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
US-4681400-A SHRINKAGE INHIBITION, ACRYLIC ESTER COPOLYMER CORE, FLUOROPOLYMER CLADDING SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 1987-07-21 — — US disclosed
Send feedback