SCHEMBL6907203

SCHEMBL6907203

CN(C)c1ccccc1CI.[MgH2]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.39
MAPT P10636 3/20 0.39
ALDH1A1 P00352 3/20 0.39
GAA P10253 2/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.38
CHEK1 O14757 1/20 0.38
NEK2 P51955 1/20 0.38
LIMK1 P53667 1/20 0.38
DYRK1A Q13627 1/20 0.38
CLK4 Q9HAZ1 1/20 0.38
CYP2D6 P10635 2/20 0.36
GLI1 P08151 1/20 0.36
CYP3A4 P08684 1/20 0.36
ATP4A P20648 1/20 0.36
ATP4B P51164 1/20 0.36
APP P05067 1/20 0.36
HTR6 P50406 1/20 0.34

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
SCHEMBL24703151 0.80 ALDH1A1 (0.41) ARMAPTALDH1A1GAATP53
SCHEMBL4420374 0.79 MAPT (0.45) ARMAPTALDH1A1GAATP53
SCHEMBL29408555 0.78 AR (0.50) ARMAPTALDH1A1GAATP53
SCHEMBL3871304 0.78 AR (0.50) ARMAPTALDH1A1GAATP53
SCHEMBL6913354 0.77 AR (0.39) ARMAPTALDH1A1GAATP53
SCHEMBL6906463 0.77 AR (0.39) ARMAPTALDH1A1GAATP53
SCHEMBL27935035 0.76 MAPT (0.41) ARMAPTALDH1A1GAATP53
SCHEMBL709848 0.76 MAPT (0.46) ARMAPTALDH1A1GAATP53
SCHEMBL249635 0.76 MAPT (0.42) ARMAPTALDH1A1GAATP53
SCHEMBL18240374 0.74 AR (0.44) ARMAPTALDH1A1GAATP53

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
WO-2004074333-A2 PROCESS FOR HOMO- OR COPOLYMERIZATIONOF CONJUGATED OLEFINES DOW GLOBAL TECHNOLOGIES INC. (US) 2004-09-02 WO disclosed