SCHEMBL9769963

SCHEMBL9769963

COCCOc1ccc(-n2nnnc2S)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.44
ALDH1A1 P00352 8/20 0.44
LMNA P02545 3/20 0.42
TSHR P16473 3/20 0.42
NPSR1 Q6W5P4 3/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.41
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 3/20 0.40
PKM P14618 2/20 0.39
HTT P42858 2/20 0.39
NLRP3 Q96P20 1/20 0.39
KCNN4 O15554 1/20 0.37

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
SCHEMBL8659115 0.84 ALDH1A1 (0.42) ALDH1A1LMNATSHRNPSR1KMT2A
SCHEMBL3418827 0.83 MAPT (0.56) ALDH1A1LMNATSHRNPSR1KMT2A
SCHEMBL3298388 0.81 ALDH1A1 (0.55) ALDH1A1LMNATSHRNPSR1KMT2A
SCHEMBL8655762 0.77 ALDH1A1 (0.41) ALDH1A1LMNATSHRNPSR1KMT2A
SCHEMBL12892334 0.77 NR4A1 (0.50) ALDH1A1LMNATSHRKMT2AMEN1
SCHEMBL9769959 0.75 PRMT1 (0.43) ALDH1A1LMNATSHRNPSR1KMT2A
SCHEMBL9769964 0.74 KCNN4 (0.54) ALDH1A1LMNATSHRNPSR1KMT2A
SCHEMBL6264097 0.72 ALDH1A1 (0.56) ALDH1A1LMNATSHRNPSR1KMT2A
SCHEMBL30620392 0.71 PRMT1 (0.49) ALDH1A1SMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL8339774 0.71 MAPT (0.52) RAB9AL3MBTL1MAPTPKMKDM4E

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-4983494-A Image forming process including heating step FUJI PHOTO FILM CO., LTD. (JP) 1991-01-08 US disclosed