SCHEMBL7754418

SCHEMBL7754418

Sc1cccc2sc(SCl)nc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.37
PSMD14 O00487 2/20 0.36
COPS5 Q92905 2/20 0.36
LMNA P02545 3/20 0.36
PDE10A Q9Y233 1/20 0.36
HPGD P15428 4/20 0.35
TDP1 Q9NUW8 3/20 0.35
FBP1 P09467 2/20 0.35
ADRA2A P08913 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
DRD2 P14416 1/20 0.35
ALOX15 P16050 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
DRD1 P21728 1/20 0.35
MC5R P33032 1/20 0.35
OPRM1 P35372 1/20 0.35
DRD3 P35462 1/20 0.35
OPRK1 P41145 1/20 0.35
CCR2 P41597 1/20 0.35

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
SCHEMBL1563617 0.85 PSMD14 (0.38) ALDH1A1PSMD14COPS5LMNAPDE10A
SCHEMBL83283 0.85 ALDH1A1 (0.50) ALDH1A1PSMD14COPS5LMNAPDE10A
SCHEMBL83284 0.84 PSMD14 (0.37) ALDH1A1PSMD14COPS5LMNAPDE10A
SCHEMBL29539652 0.82 PSMD14 (0.36) ALDH1A1PSMD14COPS5LMNAPDE10A
SCHEMBL27791854 0.82 SMN1; SMN2 (0.44) ALDH1A1PSMD14COPS5HPGDTDP1
SCHEMBL2046979 0.82 PSMD14 (0.36) ALDH1A1PSMD14COPS5LMNAPDE10A
SCHEMBL3790319 0.77 ALDH1A1 (0.58) ALDH1A1PSMD14COPS5LMNAPDE10A
SCHEMBL3067465 0.75 PSMD14 (0.42) ALDH1A1PSMD14COPS5LMNAPDE10A
SCHEMBL7074954 0.74 ALDH1A1 (0.33) ALDH1A1PSMD14COPS5LMNAHPGD
SCHEMBL2252871 0.73 PSMD14 (0.41) ALDH1A1PSMD14COPS5LMNAPDE10A

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-1077222-A1 Functionalised low unsaturation rubbers BAYER AG (DE) 2001-02-21 EP disclosed