SCHEMBL8200749

SCHEMBL8200749

CC(C)C1=C(Cl)C(Cl)=C(c2ccc(N(C)C)cc2)C[CH]1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
TSHR P16473 2/20 0.34
ALOX15 P16050 2/20 0.34
HSD17B10 Q99714 2/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HPGD P15428 2/20 0.33
GALR2 O43603 1/20 0.33
NSD2 O96028 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
RAD51 Q06609 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
SCHEMBL8203967 0.82 CYP2D6 (0.35) ALDH1A1ALOX15HSD17B10SMN1; SMN2MAPT
SCHEMBL8192460 0.71 PTGS2 (0.40) ALDH1A1HSD17B10SMN1; SMN2MAPTRAB9A
SCHEMBL14188099 0.66 ALDH1A1 (0.52) ALDH1A1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL346292 0.62 ALDH1A1 (0.61) ALDH1A1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL124209 0.61 ALDH1A1 (0.79) ALDH1A1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL11547412 0.61 ALDH1A1 (0.79) ALDH1A1TSHRALOX15HSD17B10SMN1; SMN2
Hydrochloric Acid SCHEMBL2861214 0.61 ALDH1A1 (0.58) ALDH1A1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL17678529 0.60 ALDH1A1 (0.50) ALDH1A1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL13377111 0.60 MAPT (0.45) ALDH1A1TSHRALOX15HSD17B10SMN1; SMN2
Hypochlorous Acid SCHEMBL31412000 0.60 ALDH1A1 (0.65) ALDH1A1TSHRALOX15HSD17B10SMN1; SMN2

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-6140344-A FOR TREATING PATHOLOGICAL CONDITIONS SUCH AS ASTHMA, RHINITIS, ECZEMA AND PARASITIC INFECTIONS FEATURING TISSUE EOSINOPHILIA SYNTEX (U.S.A.) INC. (US) 2000-10-31 US disclosed