SCHEMBL5417017

SCHEMBL5417017

CCS(=O)(=O)O.CS(=O)(=O)S

nearest known ligand 0.40

Known targets — ChEMBL curated mechanism

FGFR1FGFR2FGFR3FGFR4FLT1FLT4KDRPDGFRAPDGFRB

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.40
PDE4A P27815 1/20 0.40
SLC22A6 Q4U2R8 2/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP3A4 P08684 1/20 0.33
CA5A P35218 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
LMNA P02545 1/20 0.33
SLC6A6 P31641 1/20 0.33
CYP2C19 P33261 1/20 0.33
BLM P54132 1/20 0.33
CA2 P00918 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
APP P05067 1/20 0.30

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
SCHEMBL1043227 0.85 CA2 (0.44) PTGS1PDE4ASLC22A6KDM4ECYP3A4
SCHEMBL126970 0.84
SCHEMBL1904 0.84
SCHEMBL2058760 0.84 CA5A (0.46) PTGS1PDE4ASLC22A6KDM4ECYP3A4
Sulfuric Acid SCHEMBL6727151 0.81 CA5A (0.46) PTGS1PDE4AKDM4ECYP3A4CA5A
SCHEMBL4460080 0.81
Methyl Alcohol SCHEMBL23421569 0.81
SCHEMBL20533648 0.81
SCHEMBL20533683 0.81
SCHEMBL20583855 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7238489-B2 Identification of sortase gene THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-07-03 US disclosed
US-7101692-B2 Identification of sortase gene THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-09-05 US disclosed
US-20060073530-A1 Methods and compositions involving sortase B NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2006-04-06 US disclosed
EP-1416955-A4 IDENTIFICATION OF SORTASE GENE UNIV CALIFORNIA (US) 2005-06-15 EP disclosed
US-20050069984-A1 Identification of sortase gene NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-03-31 US disclosed
EP-1233780-A4 IDENTIFICATION OF SORTASE GENE UNIV CALIFORNIA (US) 2004-09-22 EP disclosed
US-6773706-B2 Identification of sortase gene THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-08-10 US disclosed
EP-1416955-A2 IDENTIFICATION OF SORTASE GENE The Regents of the University of California (US) 2004-05-12 EP disclosed
WO-2003020885-A9 IDENTIFICATION OF SORTASE GENE UNIV CALIFORNIA (US) 2004-04-01 WO disclosed
US-20030153020-A1 Identification of sortase gene NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-08-14 US disclosed
WO-2003020885-A2 IDENTIFICATION OF SORTASE GENE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2003-03-13 WO disclosed
US-20030022178-A1 Identification of sortase gene NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-01-30 US disclosed
EP-1233780-A1 IDENTIFICATION OF SORTASE GENE The Regents of the University of California (US) 2002-08-28 EP disclosed
WO-2000062804-A2 IDENTIFICATION OF SORTASE GENE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-10-26 WO disclosed
WO-1999009145-A1 IDENTIFICATION OF SORTASE GENE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-02-25 WO disclosed