SCHEMBL28745945

SCHEMBL28745945

CC=COc1ccccc1CO

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ APOBEC3G Q9HC16 1/20 0.36
▸ SLC6A2 P23975 2/20 0.36
▸ SLC6A4 P31645 2/20 0.36
▸ EPHX1 P07099 1/20 0.36
▸ PDCD1 Q15116 2/20 0.35
▸ CD274 Q9NZQ7 2/20 0.35
▸ CYP4F2 P78329 2/20 0.34
▸ CYP4A11 Q02928 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ AOC3 Q16853 1/20 0.33
▸ IDO1 P14902 1/20 0.32
▸ TAAR1 Q96RJ0 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ NFE2L2 Q16236 1/20 0.32
▸ CHRM2 P08172 1/20 0.32
▸ CHRM1 P11229 1/20 0.32

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
SCHEMBL8896624 0.78 ALDH1A1 (0.46) SLC6A2SLC6A4KDM4EALDH1A1LMNA
SCHEMBL543497 0.76 EPHX1 (0.41) APOBEC3GSLC6A2SLC6A4EPHX1PDCD1
SCHEMBL3391453 0.76 APOBEC3G (0.39) APOBEC3GSLC6A2SLC6A4EPHX1PDCD1
Ethylene Glycol SCHEMBL14875140 0.76 TP53 (0.45) KDM4EMAPK1ALDH1A1IDO1LMNA
SCHEMBL8928183 0.74 THRA (0.54) —
SCHEMBL9260031 0.74 CA2 (0.52) KDM4EMAPK1ALDH1A1LMNASMN1; SMN2
SCHEMBL8517929 0.74 CA2 (0.52) KDM4EMAPK1ALDH1A1LMNASMN1; SMN2
SCHEMBL5186490 0.73 APOBEC3G (0.36) APOBEC3GSLC6A2SLC6A4EPHX1PDCD1
SCHEMBL17820 0.73 IDO1 (0.57) ALDH1A1AOC3IDO1TAAR1LMNA
SCHEMBL30829273 0.73 IDO1 (0.57) ALDH1A1AOC3IDO1TAAR1LMNA

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
CN-1279073-C Reactive diluent composition and curable resin composition NIPPON CATALYTIC CHEM IND (JP) 2006-10-11 — — CN disclosed
CN-1625573-A Reactive diluent composition and curable resin composition NIPPON CATALYTIC CHEM IND (JP) 2005-06-08 — — CN disclosed
Send feedback