SCHEMBL11224875

SCHEMBL11224875

C=CCC1CCC2C[C@H](C(=O)O)CC[C@@H]2C1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PLG P00747 1/20 0.40
▸ PLAT P00750 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ ACE P12821 1/20 0.36
▸ KMT2A Q03164 3/20 0.34
▸ THRA P10827 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ ANPEP P15144 2/20 0.33
▸ ENPEP Q07075 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ AKR1C3 P42330 1/20 0.32
▸ AKR1C1 Q04828 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31

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
SCHEMBL11224878 1.00 PLG (0.40) PLGPLATLMNAACEKMT2A
SCHEMBL10828124 0.92 PLG (0.37) PLGPLATLMNAACEKMT2A
SCHEMBL10789253 0.84 PLG (0.48) PLGPLATLMNAACEKMT2A
SCHEMBL10818824 0.84 PLG (0.48) PLGPLATLMNAACEKMT2A
SCHEMBL11041397 0.84 PLG (0.48) PLGPLATLMNAACEKMT2A
SCHEMBL5712036 0.84 PLG (0.48) PLGPLATLMNAACEKMT2A
Hydrochloric Acid SCHEMBL10971092 0.82 PLG (0.47) PLGPLATLMNAACEKMT2A
Hydrochloric Acid SCHEMBL10971090 0.82 PLG (0.47) PLGPLATLMNAACEKMT2A
SCHEMBL1449326 0.81 PLG (0.54) PLGPLATLMNAACEKMT2A
SCHEMBL1449324 0.81 PLG (0.54) PLGPLATLMNAACEKMT2A

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-4391731-A Hydrogenated naphthalenes HOFFMANN-LA ROCHE INC. (US) 1983-07-05 — — US disclosed
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