SCHEMBL9707142

SCHEMBL9707142

CCCN(CCC)c1ccc(-c2nc(-c3ccc(N(CC)CC)cc3)c(-c3ccccc3)o2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
HTT P42858 2/20 0.47
KDM4E B2RXH2 5/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
ALDH1A1 P00352 4/20 0.41
MAPT P10636 3/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP1 P29466 1/20 0.41
CYP2C19 P33261 1/20 0.41
CASP7 P55210 1/20 0.41
ATM Q13315 1/20 0.41
MAPK13 O15264 2/20 0.41
MAPK12 P53778 2/20 0.41

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
SCHEMBL8648399 0.94 MAPK13 (0.46) SMN1; SMN2MEN1KMT2AHTTKDM4E
SCHEMBL15437400 0.94 MAPK13 (0.46) SMN1; SMN2MEN1KMT2AHTTKDM4E
SCHEMBL9707189 0.91 KMT2A (0.46) SMN1; SMN2MEN1KMT2AHTTKDM4E
SCHEMBL9246250 0.90 KDM4E (0.43) SMN1; SMN2MEN1KMT2AHTTKDM4E
SCHEMBL9707139 0.89 NOX1 (0.45) SMN1; SMN2MEN1KMT2AHTTKDM4E
SCHEMBL9707136 0.89 NOX1 (0.45) SMN1; SMN2MEN1KMT2AHTTKDM4E
SCHEMBL9707180 0.88 ALDH1A1 (0.47) SMN1; SMN2MEN1KMT2AHTTKDM4E
SCHEMBL9621032 0.88 MAPK14 (0.45) SMN1; SMN2MEN1KMT2AHTTKDM4E
SCHEMBL9707203 0.85 NR4A2 (0.40) SMN1; SMN2MEN1KMT2AHTTKDM4E
SCHEMBL14164155 0.81 RXRA (0.48) SMN1; SMN2MEN1KMT2AHTTKDM4E

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-0218422-B1 SEMICONDUCTOR LIGHT-EMITTING ELEMENT KABUSHIKI KAISHA TOSHIBA (JP) 1992-09-16 EP disclosed
US-4819057-A METAL-ORGANIC FILMS-SEMICONDUCTOR JUNCTION KABUSHIKI KAISHA TOSHIBA (JP) 1989-04-04 US disclosed
EP-0218422-A2 Semiconductor light-emitting element KABUSHIKI KAISHA TOSHIBA (JP) 1987-04-15 EP disclosed