SCHEMBL9040262

SCHEMBL9040262

ClCCCn1cnc2cc(Cl)c(Cl)cc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRPS1 P60891 6/20 0.52
MAPT P10636 3/20 0.51
HSD17B10 Q99714 1/20 0.51
LMNA P02545 4/20 0.50
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TP53 P04637 2/20 0.41
HTT P42858 1/20 0.41
GAA P10253 2/20 0.40
THRB P10828 1/20 0.40
CSNK2A2 P19784 1/20 0.40
CSNK2B P67870 1/20 0.40
CSNK2A1 P68400 1/20 0.40
CSNK2A3 Q8NEV1 1/20 0.40
CHRNA1 P02708 1/20 0.40
CHRNG P07510 1/20 0.40
CHRNB1 P11230 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40

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
Hydrochloric Acid SCHEMBL6395431 0.92 PRPS1 (0.49) PRPS1MAPTHSD17B10LMNAMEN1
SCHEMBL11563496 0.86 LMNA (0.69) PRPS1MAPTHSD17B10LMNAMEN1
SCHEMBL4678783 0.85 LMNA (0.62) PRPS1MAPTHSD17B10LMNAMEN1
SCHEMBL2632811 0.82 LMNA (0.54) PRPS1MAPTHSD17B10LMNAMEN1
SCHEMBL8875090 0.82 PRPS1 (0.49) PRPS1MAPTHSD17B10LMNAMEN1
SCHEMBL9037446 0.81 LMNA (0.76) MAPTHSD17B10LMNAMEN1KMT2A
SCHEMBL9040247 0.79 PRPS1 (0.54) PRPS1MAPTHSD17B10LMNATP53
SCHEMBL9038637 0.79 MAPT (0.57) PRPS1MAPTHSD17B10LMNATP53
SCHEMBL5630090 0.78 PRPS1 (0.43) PRPS1MAPTHSD17B10LMNAMEN1
SCHEMBL3298831 0.78 NPC1 (0.49) PRPS1MAPTHSD17B10LMNAMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0393574-B1 Hexitol derivatives KYOWA HAKKO KOGYO KK (JP) 1996-01-31 EP disclosed
US-5053408-A Cardiovascular disorders KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-10-01 US disclosed
EP-0393574-A2 Hexitol derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1990-10-24 EP disclosed