SCHEMBL10907259

SCHEMBL10907259

C=CCC(N)(CC=C)c1ccc(O)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 10/20 0.39
ESR2 Q92731 10/20 0.39
KIF11 P52732 1/20 0.39
TSHR P16473 2/20 0.38
CYP3A4 P08684 2/20 0.38
LMNA P02545 1/20 0.38
TYR P14679 1/20 0.38
AR P10275 1/20 0.38
HPGD P15428 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
HTR6 P50406 1/20 0.38
ESRRG P62508 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HTT P42858 1/20 0.38
SHBG P04278 1/20 0.36
ALDH1A1 P00352 2/20 0.36
ABAT P80404 1/20 0.33

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
SCHEMBL11587838 0.89 HTT (0.39) TSHRHTTALDH1A1
SCHEMBL16032937 0.79 ALDH1A1 (0.46) TSHRHTTALDH1A1
SCHEMBL2688608 0.78 HTT (0.53) KIF11TSHRHTTALDH1A1
SCHEMBL677567 0.78 ESR1 (0.52) ESR1ESR2KIF11TSHRCYP3A4
SCHEMBL11496599 0.77 HTT (0.41) KIF11TSHRCYP3A4LMNAHSD17B10
SCHEMBL16684959 0.77 ESR1 (0.40) ESR1ESR2KIF11TSHRCYP3A4
SCHEMBL11564596 0.77 HRH3 (0.44) ESR1ESR2KIF11TSHRCYP3A4
Hydrochloric Acid SCHEMBL11764056 0.77 HTT (0.52) KIF11TSHRCYP3A4HTTALDH1A1
SCHEMBL9418486 0.76 GABRA1 (0.37) ESR1ESR2TSHRARHPGD
SCHEMBL5459169 0.75 ESR1 (0.48) ESR1ESR2TSHRCYP3A4LMNA

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
EP-0106355-B1 ANODIC ELECTRODEPOSITION OF CHARGED AQUEOUS POWDER SLURRY E.I. DU PONT DE NEMOURS AND COMPANY (US) 1986-10-15 EP claimed