Tetrazole

Tetrazole

SCHEMBL8801092

CC(C)C[C@H](NC(=O)CN1C(=O)C(N(C)C(=O)C(N)CSSC(C)(C)C)N=C(c2ccccc2)c2cc(Cl)ccc21)C(=O)O.c1nnn[nH]1

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSB P07858 6/20 0.40
NOTCH1 P46531 1/20 0.37
RBPJ Q06330 1/20 0.37
HTR2B P41595 1/20 0.36
PDE4D Q08499 1/20 0.36
CTSL P07711 4/20 0.36
MAPT P10636 3/20 0.35
NPSR1 Q6W5P4 2/20 0.35
MCL1 Q07820 1/20 0.35
FNTA P49354 2/20 0.35
FNTB P49356 2/20 0.35
PGGT1B P53609 1/20 0.35
TP53 P04637 2/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CCKBR P32239 1/20 0.34
OXTR P30559 1/20 0.34

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
Tetrazole SCHEMBL8801776 0.93 CTSB (0.38) CTSBHTR2BPDE4DCTSLMAPT
Tetrazole SCHEMBL8801643 0.93 FNTA (0.41) CTSBHTR2BPDE4DCTSLMAPT
SCHEMBL8801080 0.87 CTSB (0.40) CTSBNOTCH1RBPJHTR2BPDE4D
Tetrazole SCHEMBL8801986 0.83 FNTA (0.47) CTSBFNTAFNTBTP53SMN1; SMN2
SCHEMBL8801769 0.81 BRD4 (0.37) CTSBCTSLMAPTNPSR1MCL1
SCHEMBL8801630 0.81 FNTA (0.43) CTSBHTR2BPDE4DCTSLMAPT
SCHEMBL8800443 0.79 CTSB (0.38) CTSBHTR2BPDE4DCTSLMAPT
SCHEMBL8669346 0.79 HTR2B (0.41) NOTCH1RBPJHTR2BPDE4DMAPT
SCHEMBL8800911 0.79 FNTA (0.45) CTSBHTR2BPDE4DCTSLMAPT
Tetrazole SCHEMBL8940457 0.77 FNTA (0.58) FNTAFNTBPGGT1BTP53OXTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1994026723-A2 ras FARNESYL TRANSFERASE INHIBITORS GENENTECH, INC. (US) 1994-11-24 WO claimed
EP-0763537-A2 Non-peptidyl Ras farnesyl transferase inhibitors GENENTECH, INC. (US) 1997-03-19 EP disclosed
EP-0698015-A1 PREPARATION OF N-CYANODITHIOIMINO-CARBONATES AND 3-MERCAPTO-5-AMINO-1H-1,2,4-TRIAZOLE GENENTECH, INC. (US) 1996-02-28 EP disclosed
WO-1994026723-A2 ras FARNESYL TRANSFERASE INHIBITORS GENENTECH, INC. (US) 1994-11-24 WO disclosed