SCHEMBL6151529

SCHEMBL6151529

CO[Al](c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA4 P22748 2/20 0.41
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
LTA4H P09960 3/20 0.35
TSHR P16473 3/20 0.33
MAPK1 P28482 2/20 0.33
ALDH1A1 P00352 2/20 0.33
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
LMNA P02545 1/20 0.33
ALOX12 P18054 1/20 0.33
ACHE P22303 1/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PDE4B Q07343 1/20 0.31
TRPA1 O75762 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
SCHEMBL733329 0.77 CA4 (0.41) CA4CA12CA1CA2CA7
SCHEMBL2968167 0.71
Hydrochloric Acid SCHEMBL6906610 0.69 TSHR (0.37) CA4CA12CA1CA2CA9
Hydrochloric Acid SCHEMBL15771658 0.69 TSHR (0.37) CA4CA12CA1CA2CA9
Bromide SCHEMBL15772385 0.69 TSHR (0.37) CA4CA12CA1CA2CA7
SCHEMBL2976898 0.65 TSHR (0.39) CA4TSHRALDH1A1APOBEC3AAPOBEC3G
SCHEMBL49939 0.63 ALDH1A1 (0.40) CA4CA12CA1CA2CA7
SCHEMBL8524658 0.63 ALDH1A1 (0.40) CA4CA12CA1CA2CA7
Anisole SCHEMBL2336805 0.63
Anisole SCHEMBL20740594 0.63

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-20050153145-A1 Makes adhesion, printing, coating, or the like on the solid surface easy without directly using a flame treatment YAMASHITA MIKIO (JP) 2005-07-14 US disclosed
EP-1538234-A2 Method of modifying solid surface and product obtained Yasuhiro, Mori (JP) 2005-06-08 EP disclosed
US-4205193-A CATALYST FROM ALUMINUM AND TITANIUM COMPOUND, ORGANOOXYGEN COMPOUND AND ORGANOSULFUR CONTAINING COMPOUND MITSUBISHI PETROCHEMICAL COMPANY LIMITED (JP) 1980-05-27 US disclosed