SCHEMBL8973755

SCHEMBL8973755

CCc1ccccc1Nc1nc(Cl)nc(Cl)n1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.61
MAPT P10636 3/20 0.53
KMT2A Q03164 3/20 0.53
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
NFKB1 P19838 3/20 0.50
P2RX7 Q99572 2/20 0.46
MEN1 O00255 2/20 0.46
MAPK1 P28482 1/20 0.46
GAA P10253 1/20 0.46
MAPK14 Q16539 1/20 0.45
POLB P06746 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
PTK2 Q05397 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL11837274 0.81 TSHR (0.80) TSHRMAPTKMT2AKDM4EALDH1A1
SCHEMBL9484073 0.79 GAA (0.46) KMT2AP2RX7MEN1GAAPOLB
SCHEMBL4544859 0.79 KCNH3 (0.51) MAPTKMT2AKDM4EALDH1A1NFKB1
Dyrene SCHEMBL7532886 0.79 TSHR (0.83) TSHRMAPTKMT2AKDM4EALDH1A1
Dyrene SCHEMBL9328304 0.79 TSHR (0.75) TSHRMAPTKMT2AKDM4EALDH1A1
SCHEMBL4544870 0.79 TSHR (0.51) TSHRALDH1A1P2RX7MAPK1GAA
Dyrene SCHEMBL16113661 0.78 TSHR (0.80) TSHRMAPTKMT2AKDM4EALDH1A1
SCHEMBL1548694 0.77 ALDH1A1 (0.54) MAPTKMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL10939229 0.77 TSHR (0.67) TSHRMAPTKMT2AKDM4EALDH1A1
Dyrene SCHEMBL13280 0.76 TSHR (1.00) TSHRMAPTKMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5561131-A INCREASING THE WOOL GROWTH BY ADMINISTERING AN ANTIPROTOZOA AGENT TO SHEEP MALLINCKRODT VETERINARY, INC. (US) 1996-10-01 US disclosed
EP-0661976-A1 DEFAUNATION METHOD MALLINCKRODT VETERINARY LIMITED (AU) 1995-07-12 EP disclosed
EP-0661976-A4 DEFAUNATION METHOD. MALLINCKRODT VETERINARY LTD (AU) 1994-07-20 EP disclosed
WO-1993002680-A1 DEFAUNATION METHOD PITMAN-MOORE AUSTRALIA LIMITED (AU) 1993-02-18 WO disclosed
US-3931165-A INSECTICIDES, HERBICIDES BARER SOL J 1976-01-06 US disclosed