SCHEMBL7970877

SCHEMBL7970877

Cc1c(C(=O)CCNC(=O)Nc2ccccc2)sc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.51
RXFP1 Q9HBX9 2/20 0.46
PRNP P04156 1/20 0.46
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.45
EPHX1 P07099 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
TP53 P04637 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
HTT P42858 2/20 0.45
HPGD P15428 1/20 0.45
FPR2 P25090 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 3/20 0.43
F10 P00742 1/20 0.43
THRB P10828 1/20 0.42
CASR P41180 1/20 0.41

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
SCHEMBL7984156 0.77 HSD11B1 (0.61) HSD11B1RXFP1PRNPALDH1A1LMNA
SCHEMBL7971233 0.76 MAPT (0.48) HSD11B1RXFP1PRNPALDH1A1LMNA
Hydrochloric Acid SCHEMBL7987810 0.75 MAPT (0.47) HSD11B1RXFP1PRNPALDH1A1LMNA
Hydrochloric Acid SCHEMBL7970754 0.74 HSD11B1 (0.45) HSD11B1RXFP1PRNPALDH1A1LMNA
SCHEMBL7981221 0.73 HSD11B1 (0.53) HSD11B1RXFP1PRNPALDH1A1LMNA
SCHEMBL4834908 0.72 HSD11B1 (0.62) HSD11B1RXFP1PRNPALDH1A1LMNA
SCHEMBL13963145 0.72 HSD11B1 (0.62) HSD11B1RXFP1PRNPALDH1A1LMNA
SCHEMBL7980700 0.72 HSD11B1 (0.47) HSD11B1RXFP1PRNPALDH1A1LMNA
SCHEMBL7984329 0.72 HSD11B1 (0.62) HSD11B1RXFP1PRNPALDH1A1LMNA
SCHEMBL2526384 0.72 RXFP1 (0.49) HSD11B1RXFP1PRNPALDH1A1LMNA

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
WO-2001007431-A2 BENZOTHIOPHENE DERIVATIVES ELI LILLY AND COMPANY (US) 2001-02-01 WO disclosed