SCHEMBL6078481

SCHEMBL6078481

N#Cc1cccc(NS(=O)(=O)c2ccc3ccc(NC(=O)Nc4ccc5ccc(S(=O)(=O)Nc6cccc(C#N)c6)cc5c4)cc3c2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.60
MAPT P10636 2/20 0.60
KMT2A Q03164 2/20 0.60
ALDH1A1 P00352 1/20 0.60
BRD1 O95696 1/20 0.53
BRPF1 P55201 1/20 0.53
KCNJ6 P48051 1/20 0.52
KCNJ5 P48544 1/20 0.52
KCNJ3 P48549 1/20 0.52
ATIC P31939 1/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
KAT6A Q92794 1/20 0.51
GAA P10253 1/20 0.50
ALOX15 P16050 1/20 0.50
CASP7 P55210 1/20 0.50
HSD17B10 Q99714 1/20 0.50
NSD2 O96028 1/20 0.48
PGR P06401 1/20 0.48

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
SCHEMBL12112988 0.83 KMT2A (0.56) MEN1MAPTKMT2AALDH1A1KCNJ6
SCHEMBL6080277 0.83 PKM (0.61) MEN1KMT2AALDH1A1
SCHEMBL2762707 0.82 CA2 (0.64) MEN1MAPTKMT2AALDH1A1ATIC
SCHEMBL6077413 0.82 NPC1 (0.62) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL6078621 0.81 MEN1 (0.55) MEN1KMT2ASMN1; SMN2
SCHEMBL6078878 0.81 MEN1 (0.55) MEN1KMT2ASMN1; SMN2
SCHEMBL6079410 0.81 MEN1 (0.55) MEN1KMT2ASMN1; SMN2
SCHEMBL6079569 0.81 MEN1 (0.55) MEN1KMT2ASMN1; SMN2
SCHEMBL6079564 0.81 MEN1 (0.54) MEN1KMT2A
SCHEMBL6078471 0.81 MEN1 (0.72) MEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7071231-B2 Naphthalene ureas as glucose uptake enhancers TELIK, INC. (US) 2006-07-04 US disclosed
EP-1181271-B1 NAPHTHALENE UREAS AS GLUCOSE UPTAKE ENHANCERS TELIK INC (US) 2005-01-19 EP disclosed
US-6458998-B1 NAPHTHALENEUREAS AS ANTIDIABETIC AGENTS TELIK, INC. 2002-10-01 US disclosed