SCHEMBL23478010

SCHEMBL23478010

C=CCc1cccc(COC)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
PPARG P37231 2/20 0.50
PPARD Q03181 2/20 0.50
PPARA Q07869 1/20 0.50
CYP3A4 P08684 4/20 0.46
PTGS1 P23219 2/20 0.46
ALOX5 P09917 2/20 0.46
AR P10275 1/20 0.46
TRPM8 Q7Z2W7 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
ALOX12 P18054 1/20 0.46
GABRA1 P14867 3/20 0.41
GABRB2 P47870 3/20 0.41
XDH P47989 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 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
SCHEMBL8151006 0.84 TSHR (0.44) ALDH1A1PPARGPPARDPPARACYP3A4
SCHEMBL487468 0.83 IDO1 (0.48) CYP3A4ERN1
SCHEMBL1325860 0.83 XDH (0.54) ALDH1A1PPARGPPARDPPARACYP3A4
SCHEMBL8209866 0.82 ERN1 (0.46) ALDH1A1SMN1; SMN2TP53L3MBTL1LMNA
Ethylene SCHEMBL28753621 0.81 XDH (0.52) ALDH1A1PPARGPPARDPPARACYP3A4
Water SCHEMBL28099990 0.81 XDH (0.52) ALDH1A1PPARGPPARDPPARACYP3A4
SCHEMBL8018936 0.79 ALDH1A1 (0.63) ALDH1A1PPARGPPARDPPARACYP3A4
SCHEMBL28831709 0.79 IDO1 (0.44) CYP3A4ERN1
SCHEMBL11787191 0.78 ALDH1A1 (0.46) ALDH1A1PPARGPPARDPPARACYP3A4
SCHEMBL1004736 0.78 IDO1 (0.41) L3MBTL1ERN1

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-20210171770-A1 RESIN COMPOSITION AND ARTICLE MADE THEREFROM ELITE ELECTRONIC MATERIAL (ZHONGSHAN) CO., LTD. (CN) 2021-06-10 US disclosed