SCHEMBL3289674

SCHEMBL3289674

Fc1ccc(NC(=S)NCc2cccnc2-c2cnn(Cc3ccccc3)c2)c(Cl)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCD O00767 2/20 0.41
SCD5 Q86SK9 2/20 0.41
L3MBTL1 Q9Y468 4/20 0.39
POLB P06746 1/20 0.38
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
PKM P14618 1/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
ALDH1A1 P00352 4/20 0.37
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
MAPKAPK2 P49137 1/20 0.36
TAS2R8 Q9NYW2 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ADORA2A P29274 1/20 0.35

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
SCHEMBL3288179 0.81 ALK (0.39) POLBMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3288540 0.81 POLB (0.46) L3MBTL1POLBMEN1KMT2ASMN1; SMN2
SCHEMBL3288118 0.80 SMN1; SMN2 (0.40) POLBMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3287069 0.79 ALDH1A1 (0.42) POLBMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3291165 0.77 P2RX7 (0.44) POLBMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3288471 0.76 SMN1; SMN2 (0.47) POLBMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3294393 0.76 SMN1; SMN2 (0.47) POLBMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3293459 0.74 LMNA (0.47) POLBMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3292928 0.74 P2RX7 (0.47)
SCHEMBL3288628 0.71 MEN1 (0.46) MEN1KMT2ASMN1; SMN2LMNAMAPT

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 SCD 4699/4885SCD5 4449/4885L3MBTL1 3366/4885
US-20120329772-A1 AMINO-TETRAZOLES ANALOGUES AND METHODS OF USE P2RX7, P2RX2, P2RX5 SCD 4699/4885SCD5 4449/4885L3MBTL1 3366/4885
US-20070049584-A1 Amino-tetrazoles analogues and methods of use P2RX7, P2RX2, P2RX5 SCD 4699/4885SCD5 4449/4885L3MBTL1 3366/4885
US-20060052374-A1 Amino-tetrazole analogues and methods of use P2RX7, P2RX2, P2RX3 SCD 4663/4885SCD5 4378/4885L3MBTL1 3035/4885

“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.