SCHEMBL6909097

SCHEMBL6909097

Cc1cccc(C)c1C(=O)[O-].Cc1cccc(C)c1C(=O)[O-].[Cd+2]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
ALDH1A1 P00352 3/20 0.44
TSHR P16473 3/20 0.40
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
TRPA1 O75762 2/20 0.37
CA2 P00918 2/20 0.37
CA4 P22748 1/20 0.37
ATM Q13315 1/20 0.37
GPR52 Q9Y2T5 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
MYC P01106 1/20 0.36
ACHE P22303 1/20 0.36
CA1 P00915 1/20 0.36

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
SCHEMBL6913550 0.95 TDP1 (0.47) TDP1L3MBTL1ALDH1A1TSHRHSD17B10
Zinc Ion SCHEMBL6907910 0.95 TDP1 (0.47) TDP1L3MBTL1ALDH1A1TSHRHSD17B10
Silver SCHEMBL31112849 0.95 TDP1 (0.47) TDP1L3MBTL1ALDH1A1TSHRHSD17B10
Potassium Ion SCHEMBL11466345 0.95 TDP1 (0.47) TDP1L3MBTL1ALDH1A1TSHRHSD17B10
SCHEMBL6914099 0.95 TDP1 (0.47) TDP1L3MBTL1ALDH1A1TSHRHSD17B10
SCHEMBL6915052 0.95 TDP1 (0.47) TDP1L3MBTL1ALDH1A1TSHRHSD17B10
SCHEMBL6915047 0.95 TDP1 (0.47) TDP1L3MBTL1ALDH1A1TSHRHSD17B10
SCHEMBL6918159 0.95 TDP1 (0.47) TDP1L3MBTL1ALDH1A1TSHRHSD17B10
SCHEMBL11079476 0.95 TDP1 (0.47) TDP1L3MBTL1ALDH1A1TSHRHSD17B10
SCHEMBL6916431 0.95 TDP1 (0.47) TDP1L3MBTL1ALDH1A1TSHRHSD17B10

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-6830704-B2 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. (JP) 2004-12-14 US disclosed
US-20030135016-A1 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. 2003-07-17 US disclosed
US-6547985-B1 Adhesive mixture TOGOSEI CO., LTD. (JP) 2003-04-15 US disclosed