SCHEMBL3290406

SCHEMBL3290406

CN(Cc1ccccc1)c1ncccc1CNC(=S)Nc1cccc(Cl)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.48
ALOX12 P18054 3/20 0.48
HPGD P15428 1/20 0.48
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
ALDH1A1 P00352 5/20 0.47
HTT P42858 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPT P10636 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL3288097 0.80 MEN1 (0.51) LMNAALOX12HPGDMEN1KMT2A
SCHEMBL3288279 0.79 MEN1 (0.57) LMNAALOX12HPGDMEN1KMT2A
SCHEMBL3290412 0.77 LMNA (0.51) LMNAALOX12HPGDMEN1KMT2A
SCHEMBL3289154 0.77 ALDH1A1 (0.54) LMNAALOX12HPGDMEN1KMT2A
SCHEMBL3287413 0.76 ALDH1A1 (0.54) LMNAALOX12HPGDMEN1KMT2A
SCHEMBL3288043 0.75 MEN1 (0.57) LMNAALOX12HPGDMEN1KMT2A
SCHEMBL3288483 0.74 ALDH1A1 (0.51) LMNAALOX12HPGDMEN1KMT2A
SCHEMBL3530286 0.73 ALDH1A1 (0.47) LMNAALOX12HPGDMEN1KMT2A
SCHEMBL3288427 0.73 KMT2A (0.52) LMNAALOX12HPGDMEN1KMT2A
SCHEMBL3289945 0.73 MEN1 (0.50) LMNAALOX12HPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546374-B2 Amino-tetrazoles analogues and methods of use ABBVIE INC. (US) 2013-10-01 US disclosed
US-20120329772-A1 AMINO-TETRAZOLES ANALOGUES AND METHODS OF USE ABBOTT LABORATORIES (US) 2012-12-27 US disclosed
US-8217067-B2 Antiinflammatory agents, antidepressants, analgesics, purinergic receptor antagonists; neurodegenerative diseases, spinal cord injuries; 1-(2,3-dichlorophenyl)-N-[(2-methylphenyl)methyl]-1H-tetraazol-5-amine ABBOTT LABORATORIES (US) 2012-07-10 US disclosed
US-7723367-B2 Amino-tetrazoles analogues and methods of use ABBOTT LABORATORIES (US) 2010-05-25 US disclosed
US-7704997-B1 Amino-tetrazole analogues and methods of use ABBOTT LABORATORIES (US) 2010-04-27 US disclosed
US-20080171733-A1 Amino-Tetrazoles Analogues and Methods of Use ABBOTT LABORATORIES (US) 2008-07-17 US disclosed
US-20070049584-A1 Amino-tetrazoles analogues and methods of use ABBVIE INC. 2007-03-01 US disclosed
EP-1747206-A1 AMINO-TETRAZOLES ANALOGUES AND METHODS OF USE ABBOTT LABORATORIES (US) 2007-01-31 EP disclosed
US-20060052374-A1 Amino-tetrazole analogues and methods of use ABBVIE INC. 2006-03-09 US disclosed
WO-2005111003-A1 AMINO-TETRAZOLES ANALOGUES AND METHODS OF USE ABBOTT LABORATORIES (US) 2005-11-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080171733-A1 Amino-Tetrazoles Analogues and Methods of Use P2RX7, P2RX2, P2RX5 LMNA 2076/4885ALOX12 2141/4885HPGD 2877/4885
US-20120329772-A1 AMINO-TETRAZOLES ANALOGUES AND METHODS OF USE P2RX7, P2RX2, P2RX5 LMNA 2076/4885ALOX12 2141/4885HPGD 2877/4885
US-20070049584-A1 Amino-tetrazoles analogues and methods of use P2RX7, P2RX2, P2RX5 LMNA 2076/4885ALOX12 2141/4885HPGD 2877/4885
US-20060052374-A1 Amino-tetrazole analogues and methods of use P2RX7, P2RX2, P2RX3 LMNA 2013/4885ALOX12 1982/4885HPGD 2988/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.