SCHEMBL9484774

SCHEMBL9484774

CC(C)CCCCCCCc1ncc(C(=O)O)cc1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 2/20 0.41
▸ GRIN2D O15399 1/20 0.41
▸ GRIN2A Q12879 1/20 0.41
▸ GRIN2B Q13224 1/20 0.41
▸ GRIN2C Q14957 1/20 0.41
▸ HCAR3 P49019 5/20 0.37
▸ HCAR2 Q8TDS4 2/20 0.37
▸ MAPK1 P28482 1/20 0.36
▸ XDH P47989 1/20 0.36
▸ DEGS1 O15121 1/20 0.35
▸ BRS3 P32247 1/20 0.35
▸ FAAH O00519 1/20 0.34
▸ KDM6B O15054 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33
▸ GABRP O00591 1/20 0.33
▸ GABRD O14764 1/20 0.33
▸ GABRA1 P14867 1/20 0.33
▸ GABRB1 P18505 1/20 0.33
▸ GABRG2 P18507 1/20 0.33
▸ GABRB3 P28472 1/20 0.33

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
SCHEMBL10459803 0.85 GRIN2D (0.35) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL10515745 0.79 ASPH (0.51) FAAHKDM6BKDM4CKDM4E
SCHEMBL9485597 0.77 RARB (0.37) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL10515854 0.74 ASPH (0.50) KDM6BKDM4CKDM4E
SCHEMBL10515374 0.74 PKM (0.49) ALDH1A1KMT2A
SCHEMBL19857480 0.74 GABRP (0.46) HCAR3HCAR2GABRPGABRDGABRA1
SCHEMBL6738014 0.73 GRIN2D (0.42) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL10356225 0.73 GRIN2D (0.42) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL10764581 0.72 HCAR2 (0.41) HCAR3HCAR2GABRPGABRDGABRA1
SCHEMBL9037560 0.71 HCAR2 (0.40) HCAR3HCAR2GABRPGABRDGABRA1

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
US-5196095-A Complexing, chelation HENKEL CORPORATION (US) 1993-03-23 — — US disclosed
EP-0523124-A1 A PROCESS FOR RECOVERING A METAL FROM AN AQUEOUS SOLUTION COMPRISING A MIXTURE OF METAL CHLORIDE HENKEL CORPORATION (US) 1993-01-20 — — EP disclosed
WO-1991015606-A1 A PROCESS FOR RECOVERING A METAL FROM AN AQUEOUS SOLUTION COMPRISING A MIXTURE OF METAL CHLORIDE HENKEL CORPORATION (US) 1991-10-17 — — WO disclosed
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