SCHEMBL29136568

SCHEMBL29136568

CCOC(C)Oc1ccc(C=O)c(OC)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
L3MBTL1 Q9Y468 1/20 0.48
CYP1A2 P05177 5/20 0.42
CYP1A1 P04798 4/20 0.42
CYP1B1 Q16678 4/20 0.42
MAPT P10636 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ERN1 O75460 2/20 0.41
MAOB P27338 2/20 0.41
KDM4E B2RXH2 2/20 0.41
TSHR P16473 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
CYP3A4 P08684 2/20 0.40
CYP2C19 P33261 2/20 0.40
CYP2E1 P05181 1/20 0.40
CYP2C8 P10632 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2A6 P11509 1/20 0.40
CYP2C9 P11712 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
SCHEMBL3924348 0.90 ALDH1A1 (0.71) ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL29136562 0.86 CYP1A2 (0.42) ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL3633730 0.82 ALDH1A1 (0.71) ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL18478003 0.79 ALDH1A1 (0.67) ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL702232 0.79 ALDH1A1 (0.71) ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL11774313 0.78 ALDH1A1 (0.61) ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL5566174 0.77 ALDH1A1 (0.80) ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL4998791 0.77 ALDH1A1 (0.47) ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL21339649 0.77 PPARA (0.33) CYP1A2CYP1A1CYP1B1MEN1KMT2A
SCHEMBL24110572 0.76 ALDH1A1 (0.47) ALDH1A1L3MBTL1CYP1A2MAPTERN1

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
CN-117362164-A Photoresist monomer compound and preparation method and application thereof 中节能万润股份有限公司 2024-01-09 CN disclosed