SCHEMBL22471791

SCHEMBL22471791

CCCCCCCCCCCCCCCCCCCCS(=O)(=O)c1ccc(N)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.60
THRB P10828 2/20 0.52
THRA P10827 1/20 0.52
CYP3A4 P08684 2/20 0.50
CYP2C9 P11712 2/20 0.50
ALDH1A1 P00352 2/20 0.50
CYP2C19 P33261 1/20 0.50
MCHR1 Q99705 1/20 0.49
CA2 P00918 7/20 0.47
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA9 Q16790 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 2/20 0.43
LMNA P02545 1/20 0.43
MPO P05164 1/20 0.43
HTR6 P50406 1/20 0.43
TXNRD1 Q16881 2/20 0.43
NPC1 O15118 1/20 0.42
MAPT P10636 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
SCHEMBL2123298 1.00 GAA (0.60) GAATHRBTHRACYP3A4CYP2C9
SCHEMBL11131722 1.00 GAA (0.60) GAATHRBTHRACYP3A4CYP2C9
SCHEMBL8158540 1.00 GAA (0.60) GAATHRBTHRACYP3A4CYP2C9
SCHEMBL8878487 1.00 GAA (0.60) GAATHRBTHRACYP3A4CYP2C9
SCHEMBL11213098 1.00 GAA (0.60) GAATHRBTHRACYP3A4CYP2C9
SCHEMBL7282032 0.92 GAA (0.64) GAATHRBTHRACYP3A4CYP2C9
SCHEMBL29980399 0.88 GAA (0.61) GAACYP3A4CYP2C9ALDH1A1CYP2C19
SCHEMBL10300267 0.85 THRB (0.55) THRBTHRACYP3A4CYP2C9ALDH1A1
SCHEMBL2148722 0.84 GAA (0.69) GAACYP3A4CYP2C9ALDH1A1CYP2C19
SCHEMBL9099326 0.83 ALDH1A1 (0.74) GAATHRBTHRACYP3A4CYP2C9

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
WO-2021020265-A1 COLORED CURABLE RESIN COMPOSITION 住友化学株式会社 2021-02-04 WO disclosed
WO-2020226099-A1 COLORED CURABLE RESIN COMPOSITION 住友化学株式会社 2020-11-12 WO disclosed
WO-2020195962-A1 COLORED CURABLE RESIN COMPOSITION, COLOR FILTER AND SOLID-STATE IMAGING ELEMENT 住友化学株式会社 2020-10-01 WO disclosed