SCHEMBL7025656

SCHEMBL7025656

Cc1c(Cl)nc(NC[C@@H]2CCCN2C(=O)OC(C)(C)C)c(=O)n1CC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.38
TPSAB1 Q15661 2/20 0.38
ALDH1A1 P00352 4/20 0.38
APP P05067 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
DRD2 P14416 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
SLC6A2 P23975 1/20 0.38
HRH2 P25021 1/20 0.38
HTR1D P28221 1/20 0.38
HTR1B P28222 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR7 P34969 1/20 0.38
DRD3 P35462 1/20 0.38
OPRK1 P41145 1/20 0.38
HTR2B P41595 1/20 0.38
PSEN1 P49768 1/20 0.38

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
SCHEMBL7021064 0.86 PRMT5 (0.46) PRMT5TPSAB1OPRD1TSHRMEN1
SCHEMBL7022729 0.83 PRMT5 (0.42) PRMT5ALDH1A1APPHTR1AADRA2A
SCHEMBL7023114 0.83 PRMT5 (0.42) PRMT5ALDH1A1APPHTR1AADRA2A
SCHEMBL7023932 0.83 PRMT5 (0.42) PRMT5ALDH1A1APPHTR1AADRA2A
SCHEMBL7016094 0.78 F2 (0.39) PRMT5TPSAB1ALDH1A1PDE7B
SCHEMBL7023796 0.77 TPSAB1 (0.41) TPSAB1ALDH1A1TSHR
SCHEMBL15056838 0.75 PRMT5 (0.43) PRMT5ALDH1A1APPHTR1AADRA2A
SCHEMBL15056219 0.75 PRMT5 (0.43) PRMT5ALDH1A1APPHTR1AADRA2A
SCHEMBL15056300 0.75 PRMT5 (0.43) PRMT5ALDH1A1APPHTR1AADRA2A
SCHEMBL7027708 0.75 TPSAB1 (0.43) TPSAB1ALDH1A1TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0997474-B1 Antithrombotic agents PFIZER (US) 2003-10-29 EP disclosed
US-6417203-B1 HETEROCYCLIC AMIDES PFIZER INC. 2002-07-09 US disclosed
US-6180627-B1 INDOLE, INDAZOLE, BENZOTRIAZOLE AND BENZIMIDAZOLE DERIVATIVES PFIZER INC. 2001-01-30 US disclosed