SCHEMBL28693125

SCHEMBL28693125

CC(C)C(c1ccccc1)(c1ccccc1)S(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.50
CYP1A2 P05177 2/20 0.50
PTPN1 P18031 1/20 0.40
CYP2C19 P33261 3/20 0.39
HIF1A Q16665 1/20 0.39
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 4/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GMNN O75496 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
PMP22 Q01453 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL11037907 0.82 CYP2D6 (0.38) CYP2D6CYP1A2PTPN1CYP2C19HIF1A
SCHEMBL18634215 0.78 CYP2D6 (0.44) CYP2D6CYP1A2PTPN1CYP2C19HIF1A
SCHEMBL11758958 0.76 PTPN1 (0.38) CYP2D6CYP1A2PTPN1TSHRSMN1; SMN2
SCHEMBL11035847 0.76 PTPN1 (0.38) CYP2D6CYP1A2PTPN1CYP2C19HIF1A
SCHEMBL27921613 0.75 CYP1A2 (0.50) CYP2D6CYP1A2PTPN1CYP2C19HIF1A
SCHEMBL29619 0.71 MAPT (0.45) CYP2D6CYP1A2PTPN1CYP2C19HIF1A
Trifluoromethanesulfonic Acid SCHEMBL28497821 0.71 CYP1A2 (0.46) CYP2D6CYP1A2PTPN1CYP2C19HIF1A
SCHEMBL16680278 0.71 CYP1A2 (0.39) CYP2D6CYP1A2PTPN1CHRM2CHRM1
SCHEMBL10807645 0.71 CYP2D6 (0.42) CYP2D6CYP1A2CYP2C19HIF1ACHRM2
SCHEMBL2526070 0.70 TSHR (0.46) CYP2D6CYP1A2PTPN1CYP2C19HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113930151-B Anti-reflective coating composition containing self-crosslinkable mercaptomelamine polymer, preparation method thereof and pattern forming method 厦门恒坤新材料科技股份有限公司 2022-06-21 CN disclosed
CN-113930151-A Anti-reflective coating composition containing self-crosslinkable mercaptomelamine polymer, preparation method thereof and pattern forming method 厦门恒坤新材料科技股份有限公司 2022-01-14 CN disclosed
CN-113929900-A Polyether high polymer and anti-reflection coating solution and preparation method thereof 厦门恒坤新材料科技股份有限公司 2022-01-14 CN disclosed
CN-113929906-A Self-crosslinkable isocyanurate polymer and anti-reflective coating composition, preparation method thereof and pattern forming method 厦门恒坤新材料科技股份有限公司 2022-01-14 CN disclosed