SCHEMBL7140817

SCHEMBL7140817

CCN(c1ccccc1I)S(C)(=O)=O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PER2 O15055 2/20 0.54
CRY1 Q16526 2/20 0.51
CRY2 Q49AN0 2/20 0.51
ALDH1A1 P00352 2/20 0.40
HSD17B10 Q99714 3/20 0.39
ESR1 P03372 3/20 0.39
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38
KMT2A Q03164 2/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
C1R P00736 1/20 0.34
MEN1 O00255 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL19337065 0.79 ALDH1A1 (0.47) ALDH1A1HSD17B10ESR1ALOX5APFEN1
SCHEMBL19337154 0.79 ALDH1A1 (0.59) PER2CRY1CRY2ALDH1A1HSD17B10
SCHEMBL1291312 0.78 ALOX5AP (0.43) PER2ALDH1A1HSD17B10ESR1ALOX5AP
SCHEMBL1291148 0.78 ESR1 (0.60) ALDH1A1HSD17B10ESR1ALOX5APFEN1
SCHEMBL31689520 0.76 CRY1 (0.49) PER2CRY1CRY2ALDH1A1KMT2A
SCHEMBL12330758 0.76 CRY1 (0.49) PER2CRY1CRY2ALDH1A1KMT2A
SCHEMBL1291494 0.75 ALDH1A1 (0.44) ALDH1A1HSD17B10ESR1ALOX5APFEN1
SCHEMBL7554537 0.74 KMT2A (0.54) ALDH1A1ESR1KMT2AMAPK1
Hydrochloric Acid SCHEMBL21048863 0.74 ALDH1A1 (0.43) ALDH1A1HSD17B10ESR1ALOX5APFEN1
SCHEMBL13563957 0.74 CRY1 (0.48) PER2CRY1CRY2HSD17B10KMT2A

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-1334087-A1 CYCLOALKYLFLUOROSULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2003-08-13 EP disclosed
WO-2002032858-A1 CYCLOALKYLFLUOROSULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2002-04-25 WO disclosed