SCHEMBL7573180

SCHEMBL7573180

Cc1ccc(C#CC/N=C/c2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 6/20 0.38
GRIN2D O15399 2/20 0.38
GRIN3B O60391 2/20 0.38
GRIN1 Q05586 2/20 0.38
GRIN2A Q12879 2/20 0.38
GRIN2B Q13224 2/20 0.38
GRIN2C Q14957 2/20 0.38
GRIN3A Q8TCU5 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MEN1 O00255 1/20 0.38
AMY1A P0DUB6 1/20 0.38
GUSB P08236 2/20 0.37
TDP1 Q9NUW8 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
GAA P10253 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
SCHEMBL7573184 1.00 LMNA (0.41) LMNAALDH1A1MAPK1KMT2APOLB
SCHEMBL7579742 0.86 LMNA (0.43) LMNAALDH1A1KMT2APOLBMAPT
SCHEMBL7579739 0.86 LMNA (0.43) LMNAALDH1A1KMT2APOLBMAPT
SCHEMBL7580944 0.86 MAPT (0.43) LMNAALDH1A1MAPK1KMT2APOLB
SCHEMBL7580939 0.86 MAPT (0.43) LMNAALDH1A1MAPK1KMT2APOLB
SCHEMBL7574921 0.83 ALDH1A1 (0.40) LMNAALDH1A1KMT2APOLBMAPT
SCHEMBL7574920 0.83 ALDH1A1 (0.40) LMNAALDH1A1KMT2APOLBMAPT
SCHEMBL7575432 0.83 KMT2A (0.38) LMNAALDH1A1MAPK1KMT2APOLB
SCHEMBL7575438 0.83 KMT2A (0.38) LMNAALDH1A1MAPK1KMT2APOLB
SCHEMBL7580371 0.82 GUSB (0.41) LMNAKMT2APOLBMAPTGRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0810199-B1 Method for producing propargylamine compounds SUMITOMO CHEMICAL CO (JP) 2002-09-25 EP disclosed
US-5756769-A Method for producing propargylamine compounds SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1998-05-26 US disclosed
EP-0810199-A1 Method for producing propargylamine compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-03 EP disclosed