SCHEMBL4447645

SCHEMBL4447645

CCCC(C=CS(=O)(=O)c1ccccc1)NC(=O)C(N)Cc1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSB P07858 3/20 0.80
CTSS P25774 2/20 0.80
CTSC P53634 2/20 0.80
CTSH P09668 1/20 0.80
CTSK P43235 1/20 0.80
CTSL P07711 5/20 0.56
CASP3 P42574 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
SCHEMBL7359034 0.90 CTSB (0.82) CTSBCTSSCTSCCTSHCTSK
SCHEMBL9889135 0.90 CTSB (0.82) CTSBCTSSCTSCCTSHCTSK
SCHEMBL4994654 0.81 CTSB (0.79) CTSBCTSSCTSCCTSHCTSK
SCHEMBL7856906 0.81 CTSB (0.78) CTSBCTSSCTSCCTSHCTSK
Hydrochloric Acid SCHEMBL5584975 0.79 CTSB (0.66) CTSBCTSSCTSCCTSHCTSK
SCHEMBL5415910 0.78 CTSB (0.59) CTSBCTSSCTSCCTSHCTSK
SCHEMBL5415904 0.78 CTSB (0.59) CTSBCTSSCTSCCTSHCTSK
SCHEMBL9891652 0.78 CTSL (0.73) CTSBCTSSCTSCCTSHCTSK
SCHEMBL29651398 0.76 GNPAT (0.56) CTSC
SCHEMBL9572282 0.75 CTSK (0.65) CTSBCTSSCTSCCTSHCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210254056-A1 IDENTIFICATION AND TARGETED MODULATION OF GENE SIGNALING NETWORKS CAMP4 THERAPEUTICS CORPORATION 2021-08-19 US disclosed
US-10877035-B2 Advanced drug development and manufacturing ICAGEN, LLC (US) 2020-12-29 US disclosed
US-20150309021-A1 Advanced Drug Development and Manufacturing LOS ALAMOS NATIONAL SECURITY, LLC 2015-10-29 US disclosed
EP-2511844-B1 X-ray microscope XRPRO SCIENCES INC (US) 2015-08-12 EP disclosed
EP-2511844-A2 Advanced drug development and manufacturing Los Alamos National Security, LLC (US) 2012-10-17 EP disclosed
EP-2084519-B1 X-RAY FLUORESCENCE ANALYSIS METHOD LOS ALAMOS NAT SECURITY LLC (US) 2012-08-01 EP disclosed
EP-2084519-A2 ADVANCED DRUG DEVELOPMENT AND MANUFACTURING Los Alamos National Security, LLC (US) 2009-08-05 EP disclosed
WO-2008127291-A2 ADVANCED DRUG DEVELOPMENT AND MANUFACTURING LOS ALAMOS NATIONAL SECURITY, LLC (US) 2008-10-23 WO disclosed
US-20080220441-A1 Advanced drug development and manufacturing THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-09-11 US disclosed