SCHEMBL19910360

SCHEMBL19910360

O=Cc1cccc(NC(=O)CNCc2ccccc2F)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.52
MEN1 O00255 4/20 0.52
KDM4E B2RXH2 3/20 0.52
BCHE P06276 1/20 0.48
ACHE P22303 1/20 0.48
RAB9A P51151 4/20 0.46
PKM P14618 1/20 0.46
MAPK1 P28482 1/20 0.46
NPC1 O15118 3/20 0.44
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
ANO1 Q5XXA6 1/20 0.41
KCNJ5 P48544 1/20 0.40
KCNJ3 P48549 1/20 0.40
F2R P25116 1/20 0.40

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
SCHEMBL21574286 0.82 KMT2A (0.49) KMT2AMEN1KDM4EBCHEACHE
SCHEMBL16709794 0.80 ALDH1A1 (0.54) KMT2AMEN1KDM4ERAB9APKM
SCHEMBL13614141 0.77 TERT (0.55) KMT2AMEN1RAB9AMAPK1ALDH1A1
SCHEMBL4008452 0.73 MAPT (0.62) KMT2AMEN1KDM4ERAB9ANPC1
SCHEMBL19328847 0.73 KDM4E (0.54) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL2702564 0.72 RAB9A (0.63) KMT2AMEN1RAB9AMAPK1NPC1
SCHEMBL5199262 0.72 MAOB (0.47) KMT2AMEN1RAB9AALDH1A1SMN1; SMN2
SCHEMBL5199245 0.72 POLB (0.46) KMT2AMEN1RAB9APKMALDH1A1
SCHEMBL2268420 0.72 RAB9A (0.60) KMT2AMEN1KDM4ERAB9APKM
SCHEMBL4010777 0.72 TSHR (0.54) KMT2AMEN1KDM4ERAB9ANPC1

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
EP-3065738-B1 COMPOSITIONS AND METHODS FOR MODULATING FARNESOID X RECEPTORS NOVARTIS AG (CH) 2018-02-28 EP disclosed