SCHEMBL14112930

SCHEMBL14112930

COc1cccc(-n2cnnc2S)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
PKM P14618 1/20 0.51
FGFR1 P11362 2/20 0.50
HTT P42858 3/20 0.47
GFER P55789 1/20 0.47
NOTUM Q6P988 1/20 0.46
PI4KA P42356 1/20 0.45
PI4K2B Q8TCG2 1/20 0.45
PI4K2A Q9BTU6 1/20 0.45
PI4KB Q9UBF8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
MGLL Q99685 1/20 0.42
RAB9A P51151 2/20 0.41
LMNA P02545 2/20 0.41
NPC1 O15118 2/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 2/20 0.41
S1PR4 O95977 1/20 0.41
S1PR1 P21453 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL11089171 0.82 ALDH1A1 (0.53) ALDH1A1PKMFGFR1HTTGFER
SCHEMBL11382140 0.81 CYP1A2 (0.52) ALDH1A1HTTPI4KAPI4K2BPI4K2A
SCHEMBL6536920 0.77 MAPT (0.43) ALDH1A1FGFR1MAPTKMT2ASMN1; SMN2
SCHEMBL14204086 0.77 OPRD1 (0.57) ALDH1A1FGFR1RAB9ALMNANPC1
SCHEMBL10719067 0.77 KMT2A (0.46) ALDH1A1NOTUMPI4KAPI4K2BPI4K2A
SCHEMBL14204026 0.77 FGFR1 (0.47) ALDH1A1FGFR1HTTNOTUMMGLL
SCHEMBL1151405 0.75 MAPK1 (0.41) ALDH1A1PKMFGFR1HTTNOTUM
SCHEMBL17153813 0.74 NOTUM (0.50) ALDH1A1PKMFGFR1HTTGFER
SCHEMBL11075544 0.74 MAPT (0.50) ALDH1A1L3MBTL1RAB9ALMNANPC1
SCHEMBL9896466 0.73 MAPK1 (0.41) ALDH1A1PKMFGFR1HTTNOTUM

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-20080160452-A1 Developer for light sensitive planographic printing plate material and manufacturing process of planographic printing plate employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-07-03 US disclosed
US-20080160452-A1 Developer for light sensitive planographic printing plate material and manufacturing process of planographic printing plate employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-07-03 US disclosed