SCHEMBL9492355

SCHEMBL9492355

NS(=O)(=O)OCCCN1CCC(C(O)(c2ccc(F)cc2)c2ccc(F)cc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 3/20 0.49
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 1/20 0.46
▸ PAX8 Q06710 1/20 0.45
▸ CYP2J2 P51589 1/20 0.43
▸ HRH1 P35367 3/20 0.43

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
Ethyl Acetate SCHEMBL9451241 0.89 CYP2J2 (0.45) KCNH2MEN1KMT2APAX8CYP2J2
SCHEMBL10722932 0.84 MEN1 (0.67) KCNH2MEN1KMT2APAX8
Hydrochloric Acid SCHEMBL10459167 0.83 MEN1 (0.66) KCNH2MEN1KMT2APAX8
SCHEMBL10461861 0.82 KCNH2 (0.70) KCNH2MEN1KMT2APAX8
SCHEMBL9786892 0.81 CYP2J2 (0.59) KCNH2MEN1PAX8CYP2J2HRH1
SCHEMBL10719616 0.80 KCNH2 (0.58) KCNH2MEN1KMT2APAX8
SCHEMBL9873774 0.80 CYP2J2 (0.56) KCNH2MEN1KMT2ACYP2J2HRH1
SCHEMBL10460508 0.80 KCNH2 (0.64) KCNH2MEN1KMT2APAX8
SCHEMBL8536666 0.80 KCNH2 (0.57) KCNH2MEN1PAX8HRH1
SCHEMBL10460949 0.79 KCNH2 (0.73) KCNH2MEN1KMT2APAX8HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5192785-A Sulfamates as antiglaucoma agents A. H. ROBINS COMPANY, INCORPORATED (US) 1993-03-09 — — US disclosed
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