SCHEMBL7471017

SCHEMBL7471017

CCS(=O)(=O)N(CC(=O)Nc1nc2ccccc2s1)C1CC(C)(C)Oc2ccc(F)cc21

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.44
HTT P42858 6/20 0.42
LMNA P02545 4/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
ALDH1A1 P00352 4/20 0.42
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PAX8 Q06710 1/20 0.41
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
SLC27A1 Q6PCB7 1/20 0.40
POLB P06746 1/20 0.40
KDM4E B2RXH2 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
RXFP1 Q9HBX9 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39

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
SCHEMBL7477380 0.84 TRPV1 (0.42) ALDH1A1NPC1RAB9AKDM4ERXFP1
SCHEMBL7469964 0.83 NPC1 (0.42) LMNAALDH1A1NPC1RAB9AKDM4E
SCHEMBL7470001 0.82 KCNE1 (0.42)
SCHEMBL7464041 0.82 SMN1; SMN2 (0.46) MEN1KMT2ASMN1; SMN2
SCHEMBL7478341 0.79 ALDH1A1 (0.48) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL7477267 0.79 ALDH1A1 (0.43) MAPK1HTTLMNAMEN1KMT2A
SCHEMBL7479262 0.79 LMNA (0.41) MAPK1HTTLMNAKMT2AALDH1A1
SCHEMBL7468807 0.78 KCNE1 (0.40) MEN1KMT2A
SCHEMBL7468844 0.78 TRPV1 (0.42) KMT2AALDH1A1SMN1; SMN2
SCHEMBL7472708 0.78 MAPT (0.48) HTTLMNAMEN1KMT2AALDH1A1

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