SCHEMBL29399627

SCHEMBL29399627

CN(C)S(=O)(=O)c1cccc(C(=O)O)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.65
▸ KMT2A Q03164 5/20 0.65
▸ RAB9A P51151 3/20 0.58
▸ ALDH1A1 P00352 7/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ NPC1 O15118 2/20 0.58
▸ TP53 P04637 1/20 0.58
▸ LMNA P02545 5/20 0.57
▸ HTT P42858 2/20 0.57
▸ MAPT P10636 1/20 0.57
▸ AKR1B1 P15121 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ F2 P00734 1/20 0.53
▸ PRSS1 P07477 1/20 0.53
▸ PRSS2 P07478 1/20 0.53
▸ PRSS3 P35030 1/20 0.53
▸ CA1 P00915 1/20 0.53
▸ CA2 P00918 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.52

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
SCHEMBL35185 1.00 MEN1 (0.65) MEN1KMT2ARAB9AALDH1A1SMN1; SMN2
SCHEMBL3653439 0.86 MEN1 (0.65) MEN1KMT2ARAB9AALDH1A1SMN1; SMN2
SCHEMBL20790417 0.85 LMNA (0.52) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL14221053 0.85 F2 (0.56) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL2848307 0.84 MEN1 (0.63) MEN1KMT2ARAB9AALDH1A1SMN1; SMN2
SCHEMBL2005622 0.84 MEN1 (0.63) MEN1KMT2ARAB9AALDH1A1SMN1; SMN2
SCHEMBL8241614 0.83 ALDH1A1 (0.55) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL17275120 0.83 F2 (0.55) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL3938764 0.83 SMN1; SMN2 (0.53) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL4132126 0.83 NPC1 (0.54) MEN1KMT2ARAB9AALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114174259-A Modulators of intracellular chloride concentration 意大利学院科技基金会 2022-03-11 — — CN claimed
CN-115279747-B FYN and VEGFR2 kinase inhibitors 罗达制药生物技术有限责任公司 2024-11-05 — — CN disclosed
CN-111601798-B Bisamide sarcomere activating compounds and uses thereof 美国安进公司 2023-08-11 — — CN disclosed
EP-4096657-A1 COMPOUNDS AND USES THEREOF Foghorn Therapeutics Inc. (US) 2022-12-07 — — EP disclosed
CN-115279747-A Novel fYN and VEGFR2 kinase inhibitors 罗达制药生物技术有限责任公司 2022-11-01 — — CN disclosed
CN-114174259-A Modulators of intracellular chloride concentration 意大利学院科技基金会 2022-03-11 — — CN disclosed
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