SCHEMBL29945017

SCHEMBL29945017

O=c1c2ccccc2oc2c(S(=O)(=O)O)cccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 12/20 0.61
PTGS2 P35354 1/20 0.54
KDM4E B2RXH2 3/20 0.53
ALDH1A1 P00352 2/20 0.53
GLA P06280 1/20 0.53
CYP3A4 P08684 1/20 0.53
MAPT P10636 1/20 0.53
HPGD P15428 1/20 0.53
PGAM1 P18669 1/20 0.53
CASP1 P29466 1/20 0.53
CASP7 P55210 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HSD17B10 Q99714 1/20 0.53
NPC1 O15118 1/20 0.53
LMNA P02545 1/20 0.53
RAB9A P51151 1/20 0.53
KDM5A P29375 1/20 0.47
EGFR P00533 1/20 0.45
TTR P02766 3/20 0.43
CYP19A1 P11511 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
SCHEMBL686660 0.88 MAOA (0.45) MAOAPTGS2KDM4EALDH1A1GLA
SCHEMBL29218969 0.82 MAOA (0.60) MAOAKDM4EALDH1A1GLACYP3A4
SCHEMBL26440481 0.79 MCL1 (0.43) MAOAKDM4EALDH1A1GLANPC1
SCHEMBL6517159 0.79 TTR (0.52) ALDH1A1HSD17B10TTR
SCHEMBL29945034 0.76 MAOA (0.47) MAOAKDM4EALDH1A1GLACYP3A4
SCHEMBL329796 0.76 MAOA (0.47) MAOAKDM4EALDH1A1GLACYP3A4
SCHEMBL1788224 0.76 MAOA (1.00) MAOAPTGS2KDM4EALDH1A1GLA
SCHEMBL12608741 0.75 MAOA (0.68) MAOAPTGS2KDM4EALDH1A1GLA
SCHEMBL27753627 0.74 MAOA (0.66) MAOAPTGS2KDM4EALDH1A1GLA
SCHEMBL17237791 0.74 NMUR2 (0.62) KDM4EALDH1A1CYP3A4MAPTHPGD

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
US-12242190-B2 Photoacid generator for chemically amplified photoresists INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2025-03-04 US claimed
US-20220308448-A1 PHOTOACID GENERATOR FOR CHEMICALLY AMPLIFIED PHOTORESISTS INTERNATIONAL BUSINESS MACHINES CORPORATION 2022-09-29 US claimed
US-12242190-B2 Photoacid generator for chemically amplified photoresists INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2025-03-04 US disclosed
US-20220308448-A1 PHOTOACID GENERATOR FOR CHEMICALLY AMPLIFIED PHOTORESISTS INTERNATIONAL BUSINESS MACHINES CORPORATION 2022-09-29 US disclosed