SCHEMBL4789889

SCHEMBL4789889

Cc1ccc(-c2ccccc2C(=O)O)c(C)c1N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 2/20 0.57
POLB P06746 2/20 0.57
ALDH1A1 P00352 7/20 0.44
MAPK1 P28482 3/20 0.44
MEN1 O00255 2/20 0.44
LMNA P02545 2/20 0.44
KMT2A Q03164 2/20 0.44
FOLH1 Q04609 1/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
RECQL P46063 1/20 0.44
CYP3A4 P08684 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
TSHR P16473 2/20 0.44
CYP2C9 P11712 2/20 0.44
NPC1 O15118 1/20 0.44
CASP3 P42574 1/20 0.44
RAB9A P51151 1/20 0.44
HBB P68871 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL3619161 0.87 MYC (0.53) MYCPOLBALDH1A1MAPK1MEN1
SCHEMBL1707748 0.84 MYC (0.58) MYCALDH1A1MAPK1MEN1LMNA
SCHEMBL1590359 0.84 MYC (0.60) MYCALDH1A1MAPK1KMT2AFOLH1
SCHEMBL28483244 0.81 MYC (0.54) MYCPOLBALDH1A1MAPK1MEN1
SCHEMBL27663826 0.79 MYC (0.61) MYCALDH1A1LMNAFOLH1MAPT
SCHEMBL15136711 0.79 MYC (0.56) MYCPOLBALDH1A1MAPK1MEN1
SCHEMBL604636 0.79 MYC (0.70) MYCPOLBALDH1A1MEN1LMNA
SCHEMBL28830921 0.79 MYC (0.55) MYCPOLBALDH1A1MAPK1KMT2A
SCHEMBL28690629 0.78 MYC (0.64) MYCPOLBALDH1A1MAPK1MEN1
Hydrochloric Acid SCHEMBL29281801 0.77 MYC (0.53) MYCPOLBALDH1A1MAPK1KMT2A

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
WO-2008124575-A1 RENIN INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 WO disclosed