SCHEMBL7477203

SCHEMBL7477203

CCS(=O)(=O)N(CC(=O)NCCN1CCCCC1)C1CC(C)(C)Oc2ccc(F)cc21

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.42
KCNE1 P15382 3/20 0.40
KCNQ1 P51787 3/20 0.40
HPGD P15428 3/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL7461292 0.93 KMT2A (0.45) TRPV1KCNE1KCNQ1HPGDALDH1A1
Hydrochloric Acid SCHEMBL7474459 0.91 TRPV1 (0.41) TRPV1KCNE1KCNQ1HPGDALDH1A1
SCHEMBL14256398 0.85 KCNE1 (0.45) TRPV1KCNE1KCNQ1HSD17B10
SCHEMBL4621983 0.85 KCNE1 (0.45) TRPV1KCNE1KCNQ1HSD17B10
SCHEMBL7474303 0.85 TRPV1 (0.46) TRPV1KCNE1KCNQ1HPGDALDH1A1
SCHEMBL7472708 0.83 MAPT (0.48) TRPV1KCNE1KCNQ1ALDH1A1MEN1
SCHEMBL7467409 0.81 L3MBTL1 (0.42) ALDH1A1MEN1KMT2A
SCHEMBL6600708 0.81 KDM4E (0.49) HPGDALDH1A1KDM4ECASP1CASP7
SCHEMBL7468526 0.80 KCNE1 (0.49) TRPV1KCNE1KCNQ1
SCHEMBL4621868 0.80 KMT2A (0.42) TRPV1KCNE1KCNQ1ALDH1A1MEN1

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