SCHEMBL17698557

SCHEMBL17698557

Cc1ccc2c(c1)C([Zr](C1=CC=CC1)=C(c1ccccc1)c1ccccc1)c1cc(C)ccc1-2

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TSHR P16473 1/20 0.32
PDE5A O76074 1/20 0.32
NPSR1 Q6W5P4 3/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
TRPM5 Q9NZQ8 1/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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 SCHEMBL813296 0.90 LMNA (0.32) LMNANPSR1
SCHEMBL6231459 0.86 NPC1 (0.32) TSHRMAPT
SCHEMBL813468 0.85 MEN1 (0.30) LMNAMEN1KMT2A
SCHEMBL17743524 0.84 RAB9A (0.35) LMNASMN1; SMN2MEN1MAPTKMT2A
SCHEMBL2803241 0.84 ALDH1A1 (0.31) LMNAMEN1KMT2A
SCHEMBL5082708 0.84 SLC6A2 (0.32) LMNASMN1; SMN2MAPTSLC6A2SLC6A4
Hydrochloric Acid SCHEMBL7617603 0.84
Hydrochloric Acid SCHEMBL9064568 0.84
Hydrochloric Acid SCHEMBL17743527 0.83 RAB9A (0.34) LMNAMEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL851746 0.83 NPC1 (0.31)

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
EP-1473323-B1 Polyethylene composition and process for producing same TOSOH CORP (JP) 2016-04-27 EP disclosed