SCHEMBL9826694

SCHEMBL9826694

CC(C)Oc1c(C(=O)Nc2nnn[nH]2)sc(-c2ccccc2)c1Br

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 15/20 0.39
PTPRC P08575 3/20 0.39
PTPN2 P17706 3/20 0.39
MPO P05164 1/20 0.37
CYSLTR1 Q9Y271 1/20 0.37
XIAP P98170 2/20 0.35
ADCY1 Q08828 1/20 0.33
BTK Q06187 1/20 0.33

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
SCHEMBL9826836 0.91 MPO (0.39) MPOCYSLTR1XIAPADCY1BTK
SCHEMBL9826617 0.83 MPO (0.37) MPOCYSLTR1
SCHEMBL9826206 0.82 MPO (0.37) MPOCYSLTR1
SCHEMBL9826224 0.82 MPO (0.37) MPOCYSLTR1
SCHEMBL9825596 0.80 MPO (0.40) MPOCYSLTR1
SCHEMBL9249134 0.79 MPO (0.50) MPOCYSLTR1
SCHEMBL9827854 0.78 L3MBTL1 (0.40) PTPN1ADCY1
SCHEMBL9826670 0.77 PTPN1 (0.63) PTPN1PTPRCPTPN2
SCHEMBL9827081 0.76 MPO (0.35) MPOCYSLTR1
SCHEMBL9825931 0.76 MPO (0.39) MPOCYSLTR1

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-0249236-B1 N-1H-TETRAZOL-5-YL-(5-RING)-CARBOXAMIDE-DERIVATIVES, A PROCESS FOR THEIR MANUFACTURE, AND THE USE THEREOF WARNER-LAMBERT COMPANY (US) 1991-04-24 EP claimed
US-4748183-A N-1H-tetrazol-5-yl-2-thiophene carboxamides, N-1H-tetrazol-5-yl-2-pyrrole carboxamides, N-1H-tetrazol-5-yl-2-furan carboxamides, and anti-allergic and anti-inflammatory use thereof WARNER-LAMBERT COMPANY (US) 1988-05-31 US claimed
EP-0249236-A1 N-1H-Tetrazol-5-yl-(5-Ring)-carboxamide-derivatives, a process for their manufacture, and the use thereof WARNER-LAMBERT COMPANY (US) 1987-12-16 EP claimed