SCHEMBL7721157

SCHEMBL7721157

CCCSc1nc2ccccc2n1C(C)C

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
PTGDR2 Q9Y5Y4 3/20 0.47
POLB P06746 2/20 0.47
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 2/20 0.47
HSD17B10 Q99714 1/20 0.47
AR P10275 1/20 0.45
TSHR P16473 2/20 0.44
GAA P10253 2/20 0.44
LMNA P02545 2/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
GLA P06280 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL7721150 0.88 LMNA (0.51) SMN1; SMN2KMT2AMEN1POLBALDH1A1
SCHEMBL7726932 0.79 HSD17B10 (0.53) SMN1; SMN2KMT2AMEN1POLBALDH1A1
SCHEMBL7721154 0.78 ALDH1A1 (0.50) SMN1; SMN2KMT2AMEN1ALDH1A1KDM4E
SCHEMBL7721559 0.78 SMN1; SMN2 (0.53) SMN1; SMN2KMT2AMEN1POLBALDH1A1
SCHEMBL7721161 0.78 PDE10A (0.54) SMN1; SMN2KMT2AMEN1POLBALDH1A1
SCHEMBL12195231 0.74 KDM4E (0.67) SMN1; SMN2KMT2AMEN1PTGDR2ALDH1A1
SCHEMBL7721500 0.72 POLB (0.63) SMN1; SMN2KMT2AMEN1POLBALDH1A1
SCHEMBL5115286 0.71 PTGDR2 (0.85) KMT2AMEN1PTGDR2POLB
SCHEMBL2854775 0.70 HSD17B10 (0.57) SMN1; SMN2KMT2APOLBALDH1A1KDM4E
SCHEMBL1980314 0.70 HSD17B10 (0.57) SMN1; SMN2KMT2APOLBALDH1A1KDM4E

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-6875765-B2 Arylsulfonamide ethers, and methods of use thereof WARNER-LAMBERT COMPANY (US) 2005-04-05 US disclosed