SCHEMBL10748366

SCHEMBL10748366

C=C(CS)C(=O)Oc1ccc2ccccc2c1N1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
ALDH1A1 P00352 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 5/20 0.42
POLB P06746 2/20 0.42
HTT P42858 1/20 0.42
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
KDM4E B2RXH2 4/20 0.39
KMT2A Q03164 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MEN1 O00255 1/20 0.39
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL10748360 0.83 TSHR (0.42) TSHRALDH1A1L3MBTL1MAPTPOLB
SCHEMBL4830574 0.74 ALDH1A1 (0.51) TSHRALDH1A1L3MBTL1MAPTPOLB
SCHEMBL10750357 0.73 HPGD (0.41) L3MBTL1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL10752270 0.73 WDR5 (0.40) ALDH1A1MAPTKDM4EKMT2ANPC1
SCHEMBL10752170 0.73 NCEH1 (0.45) TSHRALDH1A1MAPTNPC1RAB9A
SCHEMBL16370943 0.70 NPC1 (0.46) TSHRALDH1A1L3MBTL1MAPTPOLB
SCHEMBL10748356 0.69 MAPT (0.44) TSHRALDH1A1MAPTPOLBHTT
SCHEMBL5313808 0.68 KDM4E (0.51) TSHRALDH1A1MAPTPOLBKDM4E
SCHEMBL17065812 0.67 PRKDC (0.46) TSHRALDH1A1L3MBTL1MAPTPOLB
SCHEMBL5168060 0.67 KDM4E (0.48) ALDH1A1MAPTPOLBHTTKDM4E

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-4654431-A Photopolymerizable thioacrylate monomers EASTMAN KODAK COMPANY (US) 1987-03-31 US disclosed