SCHEMBL11064205

SCHEMBL11064205

C=C(C)C(=O)Oc1c(C=CC)cccc1C=CC

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.41
NFE2L2 Q16236 2/20 0.37
KMT2A Q03164 3/20 0.35
ATM Q13315 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.34
IAPP P10997 1/20 0.33
MEN1 O00255 2/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
LMNA P02545 1/20 0.32
CYP1A1 P04798 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
ALOX5 P09917 1/20 0.31

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
SCHEMBL11064202 1.00 ELANE (0.41) ELANENFE2L2KMT2AATMTRPM8
SCHEMBL10966783 0.80 DHFR (0.36) ELANEKMT2AATM
SCHEMBL10966777 0.80 DHFR (0.36) ELANEKMT2AATM
SCHEMBL11015183 0.79 THRB (0.41) ELANENFE2L2KMT2AATMMEN1
SCHEMBL11015181 0.79 THRB (0.41) ELANENFE2L2KMT2AATMMEN1
SCHEMBL10961953 0.78 ELANE (0.31) ELANE
SCHEMBL10961955 0.78 ELANE (0.31) ELANE
SCHEMBL11048493 0.78 THRB (0.42) NFE2L2KMT2ATRPM8MEN1KDM4E
SCHEMBL11048489 0.78 THRB (0.42) NFE2L2KMT2ATRPM8MEN1KDM4E
SCHEMBL11018514 0.76 TSHR (0.33) ELANENFE2L2KMT2AMEN1ALDH1A1

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-4439291-A Acrylate-containing compositions and their polymerization CIBA-GEIGY CORPORATION (US) 1984-03-27 US disclosed