SCHEMBL14219266

SCHEMBL14219266

CC(C)CC(C)(C(=O)Oc1cccc2ccccc12)C(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ PGR P06401 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ PTGS1 P23219 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ KDM4E B2RXH2 3/20 0.47
▸ KMT2A Q03164 3/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ HPGD P15428 2/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ MMP2 P08253 1/20 0.42
▸ NR2E1 Q9Y466 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ PSMB5 P28074 1/20 0.39
▸ HTR1B P28222 2/20 0.39
▸ OGG1 O15527 1/20 0.39
▸ CARM1 Q86X55 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
SCHEMBL11991243 0.79 ALDH1A1 (0.54) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL31748924 0.78 ALDH1A1 (0.60) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL1538258 0.78 ALDH1A1 (0.60) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL7265465 0.76 ALDH1A1 (0.54) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL8003388 0.75 ALDH1A1 (0.57) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL7737365 0.75 ALDH1A1 (0.57) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL12128703 0.75 ALDH1A1 (0.57) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL1579492 0.74 ALDH1A1 (0.55) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL18671924 0.73 ALDH1A1 (0.51) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL7265474 0.73 ALDH1A1 (0.54) ALDH1A1HSD17B10PGRGAAPTGS1

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-1556896-B1 ANTI-REFLECTIVE COMPOSITIONS COMPRISING TRIAZINE COMPOUNDS BREWER SCIENCE INC (US) 2008-04-09 — — EP disclosed
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