SCHEMBL4883430

SCHEMBL4883430

C(/C=N/OCCc1ccccc1)=N\OCCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.54
AKR1B10 O60218 3/20 0.43
AKR1B1 P15121 3/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
IDO1 P14902 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
HCAR2 Q8TDS4 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
CASP1 P29466 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
TDP1 Q9NUW8 3/20 0.39

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
SCHEMBL14667499 0.83 TAAR1 (0.51) TAAR1AKR1B10AKR1B1CA1CA2
SCHEMBL9944291 0.80 TAAR1 (0.49) TAAR1AKR1B10AKR1B1CA1CA2
SCHEMBL9945276 0.80 TAAR1 (0.49) TAAR1AKR1B10AKR1B1CA1CA2
SCHEMBL2045290 0.77 TSHR (0.50) CA1CA2CA9IDO1PPARG
SCHEMBL6873643 0.77 CA1 (0.45) TAAR1CA1CA2CA9IDO1
SCHEMBL11522499 0.77 TSHR (0.50) CA1CA2CA9IDO1PPARG
SCHEMBL6873640 0.76 CA1 (0.44) TAAR1CA1CA2CA9IDO1
SCHEMBL3819917 0.76 CA1 (0.48) TAAR1CA1CA2CA9IDO1
Hydrochloric Acid SCHEMBL3952996 0.74 CA1 (0.47) TAAR1AKR1B10AKR1B1CA1CA2
SCHEMBL31220250 0.74 GRIN1 (0.46) TAAR1AKR1B10AKR1B1IDO1PPARG

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-7361712-B2 Water absorbing agent, process for its production, and absorbers and absorbent articles made by using the agent SAN-DIA POLYMERS, LTD. (JP) 2008-04-22 US disclosed
US-20050080194-A1 Water absorbing agent, process for its production, and absorbers and absorbent articles made by using the agent SAN-DIA POLYMERS, LTD. (JP) 2005-04-14 US disclosed
EP-1457541-A1 WATER ABSORBING AGENT, PROCESS FOR ITS PRODUCTION, AND ABSORBERS AND ABSORBENT ARTICLES MADE BY USING THE AGENT San-Dia Polymers, Ltd. (JP) 2004-09-15 EP disclosed