SCHEMBL3287069

SCHEMBL3287069

Fc1cc(-c2ncccc2CNC(=S)Nc2ccc(F)c(Cl)c2Cl)ccn1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 1/20 0.42
LMNA P02545 6/20 0.41
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
MAPT P10636 3/20 0.41
PKM P14618 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
ALOX12 P18054 2/20 0.40
POLB P06746 2/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 2/20 0.37
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36

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
SCHEMBL3288118 0.87 SMN1; SMN2 (0.40) ALDH1A1SMN1; SMN2RAB9ANPC1LMNA
SCHEMBL3291165 0.86 P2RX7 (0.44) ALDH1A1SMN1; SMN2RAB9ANPC1LMNA
SCHEMBL3288540 0.86 POLB (0.46) ALDH1A1SMN1; SMN2RAB9ANPC1LMNA
SCHEMBL3288628 0.83 MEN1 (0.46) ALDH1A1SMN1; SMN2RAB9ANPC1LMNA
SCHEMBL3294393 0.82 SMN1; SMN2 (0.47) ALDH1A1SMN1; SMN2RAB9ANPC1LMNA
SCHEMBL3288471 0.82 SMN1; SMN2 (0.47) ALDH1A1SMN1; SMN2RAB9ANPC1LMNA
SCHEMBL3293459 0.81 LMNA (0.47) ALDH1A1SMN1; SMN2RAB9ANPC1LMNA
SCHEMBL3288179 0.81 ALK (0.39) ALDH1A1SMN1; SMN2RAB9ANPC1LMNA
SCHEMBL3289674 0.79 SCD (0.41) ALDH1A1SMN1; SMN2RAB9ANPC1LMNA
SCHEMBL3296043 0.78 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2RAB9ANPC1LMNA

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 ALDH1A1 3041/4885SMN1; SMN2 3761/4885RAB9A 2726/4885
US-20120329772-A1 AMINO-TETRAZOLES ANALOGUES AND METHODS OF USE P2RX7, P2RX2, P2RX5 ALDH1A1 3041/4885SMN1; SMN2 3761/4885RAB9A 2726/4885
US-20070049584-A1 Amino-tetrazoles analogues and methods of use P2RX7, P2RX2, P2RX5 ALDH1A1 3041/4885SMN1; SMN2 3761/4885RAB9A 2726/4885
US-20060052374-A1 Amino-tetrazole analogues and methods of use P2RX7, P2RX2, P2RX3 ALDH1A1 3045/4885SMN1; SMN2 3742/4885RAB9A 2680/4885

“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.