SCHEMBL8612082

SCHEMBL8612082

Cc1ccc(C)c(S(=O)(=O)O)c1.[Cu]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
GAA P10253 2/20 0.50
TSHR P16473 2/20 0.50
POLB P06746 1/20 0.44
RECQL P46063 1/20 0.44
ESR2 Q92731 1/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
CYP2C19 P33261 1/20 0.43
MEN1 O00255 1/20 0.43
G6PD P11413 1/20 0.43
HTT P42858 3/20 0.42
KDM4E B2RXH2 1/20 0.42
F2 P00734 1/20 0.42
MAPT P10636 1/20 0.42
XBP1 P17861 1/20 0.42
EDNRB P24530 1/20 0.41
EDNRA P25101 1/20 0.41

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
SCHEMBL246828 0.98 ALDH1A1 (0.51) ALDH1A1GAATSHRPOLBRECQL
SCHEMBL30810186 0.96 ALDH1A1 (0.50) ALDH1A1GAATSHRPOLBRECQL
Iodide SCHEMBL27934627 0.96 ALDH1A1 (0.50) ALDH1A1GAATSHRPOLBRECQL
Hydrochloric Acid SCHEMBL27541968 0.96 ALDH1A1 (0.50) ALDH1A1GAATSHRPOLBRECQL
SCHEMBL1639914 0.96 ALDH1A1 (0.50) ALDH1A1GAATSHRPOLBRECQL
Water SCHEMBL15452952 0.96 ALDH1A1 (0.50) ALDH1A1GAATSHRPOLBRECQL
Water SCHEMBL4808465 0.96 ALDH1A1 (0.50) ALDH1A1GAATSHRPOLBRECQL
SCHEMBL28815614 0.96 ALDH1A1 (0.50) ALDH1A1GAATSHRPOLBRECQL
SCHEMBL9317288 0.96 ALDH1A1 (0.50) ALDH1A1GAATSHRPOLBRECQL
Ethylene Glycol SCHEMBL9785352 0.90 ALDH1A1 (0.46) ALDH1A1GAATSHRPOLBRECQL

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5723075-A HEAT RESISTANT ABSORBERS WITH RESINS FOR SHIELDS NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1998-03-03 US claimed
US-5236633-A Blend of transparent polymer, thiourea and copper compounds JUJO PAPER CO., LTD. (JP) 1993-08-17 US claimed
EP-0611754-B1 Dimerized thiourea derivatives, near-infrared absorbents comprising the same, and heat wave shielding materials comprising the same JUJO PAPER CO LTD (JP) 1998-04-22 EP disclosed
US-5723075-A HEAT RESISTANT ABSORBERS WITH RESINS FOR SHIELDS NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1998-03-03 US disclosed
US-5354514-A Heating mixture of thioamide compound and copper- or lead-containing compound JUJO PAPER CO., LTD. (JP) 1994-10-11 US disclosed
EP-0611754-A1 Dimerized thiourea derivatives, near-infrared absorbents comprising the same, and heat wave shielding materials comprising the same NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1994-08-24 EP disclosed
US-5236633-A Blend of transparent polymer, thiourea and copper compounds JUJO PAPER CO., LTD. (JP) 1993-08-17 US disclosed