SCHEMBL7464899

SCHEMBL7464899

CCS(=O)(=O)N(CC(=O)Nc1nc[nH]n1)C1CC(C)(C)Oc2ccc(F)cc21

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNE1 P15382 3/20 0.40
KCNQ1 P51787 3/20 0.40
TRPV1 Q8NER1 14/20 0.37
CYP3A4 P08684 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL7470001 0.88 KCNE1 (0.42) KCNE1KCNQ1TRPV1CYP3A4
SCHEMBL7476073 0.86 KCNE1 (0.40) KCNE1KCNQ1TRPV1CYP3A4MEN1
SCHEMBL4623467 0.83 TRPV1 (0.42) KCNE1KCNQ1TRPV1CYP3A4RAB9A
SCHEMBL7464041 0.83 SMN1; SMN2 (0.46) KCNE1KCNQ1TRPV1CYP3A4MEN1
SCHEMBL7468844 0.82 TRPV1 (0.42) KCNE1KCNQ1TRPV1CYP3A4KMT2A
SCHEMBL7477267 0.82 ALDH1A1 (0.43) KCNE1KCNQ1TRPV1MEN1KMT2A
SCHEMBL7476659 0.81 KCNE1 (0.40) KCNE1KCNQ1TRPV1CYP3A4
SCHEMBL7478341 0.80 ALDH1A1 (0.48) KCNE1KCNQ1TRPV1CYP3A4MEN1
SCHEMBL7468807 0.80 KCNE1 (0.40) KCNE1KCNQ1TRPV1CYP3A4MEN1
SCHEMBL7468526 0.80 KCNE1 (0.49) KCNE1KCNQ1TRPV1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0905131-B1 Sulfonamid-substituted chromans, process for their preparation, their use as medicine, and pharmaceutical preparation containing them AVENTIS PHARMA GMBH (DE) 2002-04-10 EP disclosed
EP-0905131-A1 Sulfonamid-substituted chromans, process for their preparation, their use as medicine, and pharmaceutical preparation containing them Hoechst Marion Roussel Deutschland GmbH (DE) 1999-03-31 EP disclosed