SCHEMBL4965862

SCHEMBL4965862

COC1(Cl)C=CC=CC1c1ccccc1Cl

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.36
RCOR1 Q9UKL0 1/20 0.36
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GLA P06280 2/20 0.33
GAA P10253 2/20 0.33
HPGD P15428 2/20 0.33
CASP1 P29466 2/20 0.33
CASP7 P55210 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TP53 P04637 2/20 0.32
RECQL P46063 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
SCHEMBL11001834 0.63
SCHEMBL16055004 0.62 HTR2C (0.36) KDM4EALDH1A1GAAHPGDL3MBTL1
SCHEMBL19585448 0.62 ALDH1A1 (0.31) ALDH1A1
SCHEMBL4609631 0.62 MEN1 (0.34) KDM4EGAATSHR
SCHEMBL3726216 0.61
SCHEMBL28239632 0.61 SMN1; SMN2 (0.38) KDM1ARCOR1KDM4EALDH1A1GLA
SCHEMBL11266183 0.60 KDM1A (0.34) KDM1A
1,2-Dichlorobenzene SCHEMBL28018119 0.60 LMNA (0.39) TSHR
SCHEMBL12854975 0.59 CA12 (0.31)
SCHEMBL20566162 0.59 HTR2C (0.35) KDM1ARCOR1KDM4EALDH1A1GAA

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
EP-1871759-A1 BENZODIOXANE AND BENZODIOXOLANE DERIVATIVES AND USES THEREOF Wyeth a Corporation of the State of Delaware (US) 2008-01-02 EP disclosed
WO-2006116158-A1 BENZODIOXANE AND BENZODIOXOLANE DERIVATIVES AND USES THEREOF WYETH (US) 2006-11-02 WO disclosed