SCHEMBL30499693

SCHEMBL30499693

O=C(NC(=O)c1c(Cl)cccc1Cl)Nc1ccc(I)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
NPC1 O15118 5/20 0.46
RAB9A P51151 5/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPK1 P28482 1/20 0.44
SLC2A1 P11166 1/20 0.43
PYGL P06737 2/20 0.43
PPIA P62937 1/20 0.43
GAA P10253 3/20 0.42
TLR7 Q9NYK1 1/20 0.42
MAPT P10636 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MAOB P27338 1/20 0.42
JAK2 O60674 2/20 0.42
JAK1 P23458 2/20 0.42
TYK2 P29597 2/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL7602947 1.00 MEN1 (0.47) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL7604719 0.88 EPHX1 (0.46) MEN1KMT2ANPC1RAB9APYGL
SCHEMBL30499674 0.88 EPHX1 (0.46) MEN1KMT2ANPC1RAB9APYGL
SCHEMBL30499679 0.88 NPC1 (0.50) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL7759303 0.88 RAB9A (0.52) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL7602876 0.88 NPC1 (0.50) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL7605671 0.88 SLC2A1 (0.50) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL7607938 0.84 NPC1 (0.48) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL30499699 0.84 NPC1 (0.48) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL9352535 0.81 RAB9A (0.61) MEN1KMT2ANPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111988996-B Improving yield of nut bearing plants UPL有限责任公司 2023-07-14 CN disclosed