SCHEMBL10429712

SCHEMBL10429712

CCCCCCCCCCCCCCCCCCOC1COCC1OCCCCCCCCCCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 4/20 0.47
ALDH1A1 P00352 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
RECQL P46063 2/20 0.36
TSHR P16473 2/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
EPHX2 P34913 1/20 0.36
BLM P54132 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PPP5C P53041 1/20 0.36
SPHK2 Q9NRA0 1/20 0.36
SPHK1 Q9NYA1 1/20 0.36
THRB P10828 2/20 0.35
MEN1 O00255 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 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
SCHEMBL10429908 1.00 GBA1 (0.47) GBA1ALDH1A1TDP1RECQLTSHR
SCHEMBL10429764 1.00 GBA1 (0.47) GBA1ALDH1A1TDP1RECQLTSHR
SCHEMBL10429763 1.00 GBA1 (0.47) GBA1ALDH1A1TDP1RECQLTSHR
SCHEMBL10429909 1.00 GBA1 (0.47) GBA1ALDH1A1TDP1RECQLTSHR
SCHEMBL10429711 1.00 GBA1 (0.47) GBA1ALDH1A1TDP1RECQLTSHR
SCHEMBL24735672 0.88 GBA1 (0.41) GBA1ALDH1A1TDP1RECQLTSHR
SCHEMBL24735737 0.84 GBA1 (0.39) GBA1ALDH1A1TDP1SMN1; SMN2PPP5C
SCHEMBL11672013 0.83 ALDH1A1 (0.47) GBA1ALDH1A1TDP1RECQLTSHR
SCHEMBL18784316 0.83 ALDH1A1 (0.47) GBA1ALDH1A1TDP1RECQLTSHR
SCHEMBL18784323 0.83 ALDH1A1 (0.47) GBA1ALDH1A1TDP1RECQLTSHR

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
US-4939277-A Aprotic polar solvents; high dielectric; cis configuration MITSUBISHI KASEI CORPORATION (JP) 1990-07-03 US claimed
US-4939277-A Aprotic polar solvents; high dielectric; cis configuration MITSUBISHI KASEI CORPORATION (JP) 1990-07-03 US disclosed