SCHEMBL8587130

SCHEMBL8587130

CC(C)(/C=C\[Sn](C)(C)C)c1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPK1 P28482 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HTT P42858 1/20 0.41
CYP19A1 P11511 4/20 0.36
TSHR P16473 1/20 0.34
HIF1A Q16665 1/20 0.34
POLB P06746 1/20 0.34
CYP2A6 P11509 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SLC6A2 P23975 1/20 0.31
HTR2A P28223 1/20 0.31
SLC6A4 P31645 1/20 0.31
HRH1 P35367 1/20 0.31
HTR2B P41595 1/20 0.31

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
SCHEMBL8587135 1.00 MEN1 (0.43) MEN1KMT2AMAPK1NPSR1LMNA
SCHEMBL8582990 0.75 MEN1 (0.46) MEN1KMT2AMAPK1NPSR1LMNA
SCHEMBL8582997 0.75 MEN1 (0.46) MEN1KMT2AMAPK1NPSR1LMNA
SCHEMBL8585468 0.74 SMN1; SMN2 (0.38) MEN1KMT2AMAPK1NPSR1LMNA
SCHEMBL8585469 0.74 SMN1; SMN2 (0.38) MEN1KMT2AMAPK1NPSR1LMNA
SCHEMBL7621951 0.72 SMN1; SMN2 (0.44) MEN1KMT2AMAPK1NPSR1LMNA
SCHEMBL7621956 0.72 SMN1; SMN2 (0.44) MEN1KMT2AMAPK1NPSR1LMNA
SCHEMBL20876285 0.72 KMT2A (0.52) MEN1KMT2AMAPK1NPSR1LMNA
SCHEMBL1806495 0.72 MEN1 (0.52) MEN1KMT2AMAPK1NPSR1LMNA
SCHEMBL2799509 0.70 MEN1 (0.50) MEN1KMT2AMAPK1NPSR1LMNA

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
WO-1998020878-A1 5-[φ-(SUBSTITUTED ARYL)ALKENYLENE AND ALKYNYLENE]-2,4-DIAMINOPYRIMIDINES AS PESTICIDES FMC CORPORATION (US) 1998-05-22 WO disclosed
US-5696259-A 2,4-diamino-5-iodopyrimidines useful as pesticide intermediates FMC CORPORATION (US) 1997-12-09 US disclosed
US-5622954-A INSECTICIDE FMC CORPORATION (US) 1997-04-22 US disclosed