SCHEMBL6913554

SCHEMBL6913554

Cc1cccc(C)c1C(=O)O.[GaH3]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.59
TDP1 Q9NUW8 1/20 0.59
KDM4E B2RXH2 3/20 0.52
ALDH1A1 P00352 3/20 0.52
HPGD P15428 2/20 0.52
HSD17B10 Q99714 2/20 0.52
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA7 P43166 2/20 0.50
CA9 Q16790 2/20 0.50
CA14 Q9ULX7 2/20 0.50
KMT2A Q03164 2/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
MYC P01106 1/20 0.47
FABP3 P05413 1/20 0.45
FABP4 P15090 1/20 0.45
NOTUM Q6P988 1/20 0.43
MCL1 Q07820 1/20 0.42

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
SCHEMBL355272 0.97 TDP1 (0.61) L3MBTL1TDP1KDM4EALDH1A1HPGD
Bromide SCHEMBL6113408 0.95 TDP1 (0.59) L3MBTL1TDP1KDM4EALDH1A1HPGD
SCHEMBL6909100 0.95 TDP1 (0.59) L3MBTL1TDP1KDM4EALDH1A1HPGD
Iodide SCHEMBL6113169 0.95 TDP1 (0.59) L3MBTL1TDP1KDM4EALDH1A1HPGD
SCHEMBL6907913 0.95 TDP1 (0.59) L3MBTL1TDP1KDM4EALDH1A1HPGD
SCHEMBL11466346 0.95 TDP1 (0.59) L3MBTL1TDP1KDM4EALDH1A1HPGD
SCHEMBL6916435 0.95 TDP1 (0.59) L3MBTL1TDP1KDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL6113042 0.95 TDP1 (0.59) L3MBTL1TDP1KDM4EALDH1A1HPGD
SCHEMBL6916441 0.95 TDP1 (0.59) L3MBTL1TDP1KDM4EALDH1A1HPGD
SCHEMBL11079483 0.95 TDP1 (0.59) L3MBTL1TDP1KDM4EALDH1A1HPGD

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