SCHEMBL7724533

SCHEMBL7724533

CCOC(=O)C1(CC)C=CC(CC)=CC1N

nearest known ligand 0.31

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 3/20 0.31
ABCC1 P33527 1/20 0.31
OPRM1 P35372 2/20 0.30
OPRD1 P41143 2/20 0.30
OPRK1 P41145 2/20 0.30
SLC22A1 O15245 1/20 0.30
SLC6A4 P31645 1/20 0.30
ADRA1A P35348 1/20 0.30
KCNH2 Q12809 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL11440563 0.81
SCHEMBL1004396 0.66 BRD4 (0.31) KDM4EALDH1A1TSHRSMN1; SMN2POLB
SCHEMBL25213317 0.64
SCHEMBL28625080 0.62 ATM (0.30) ALDH1A1
SCHEMBL21799341 0.60 ALOX15 (0.33) ALDH1A1LMNAHSD17B10
SCHEMBL28898305 0.59 GAA (0.32) TSHRPOLBGAAMAPK1
SCHEMBL7595195 0.59
SCHEMBL9416759 0.58 ALDH1A1 (0.46) ALDH1A1TSHRSMN1; SMN2POLBGAA
SCHEMBL31017989 0.58 CYP1A2 (0.35) ALDH1A1SMN1; SMN2GAAOPRM1OPRD1
SCHEMBL11361961 0.58

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-108697586-B Photopolymerization initiator and photocurable composition 株式会社德山齿科 2021-07-06 CN disclosed
US-6399287-B1 Method for forming fluorescent film in PDP by using a photopolymerizable photosensitive phosphor paste composition LG ELECTRONICS INC. (KR) 2002-06-04 US disclosed