SCHEMBL935010

SCHEMBL935010

Cc1cc(O)c(CC=O)cc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
CYP3A4 P08684 4/20 0.38
NPSR1 Q6W5P4 3/20 0.38
HTT P42858 3/20 0.38
HPGD P15428 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 7/20 0.35
KDM4E B2RXH2 5/20 0.34
ALDH1A1 P00352 4/20 0.34
MAPK1 P28482 2/20 0.34
G6PD P11413 2/20 0.34
PKM P14618 1/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34
CCR6 P51684 1/20 0.34

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
SCHEMBL3656901 0.89 NPSR1 (0.41) MEN1KMT2ACYP3A4NPSR1HTT
SCHEMBL9952911 0.86 CYP3A4 (0.35) MEN1KMT2ACYP3A4NPSR1HTT
SCHEMBL10225867 0.86 MEN1 (0.39) MEN1KMT2ACYP3A4NPSR1HTT
SCHEMBL14755443 0.85 MAPT (0.43) MEN1KMT2ACYP3A4NPSR1HTT
SCHEMBL20270701 0.84 IMPDH2 (0.35) MEN1KMT2ACYP3A4NPSR1HTT
SCHEMBL14742524 0.84 ALOX12 (0.35) MEN1KMT2ACYP3A4NPSR1HTT
SCHEMBL2011119 0.84 LMNA (0.43) MEN1KMT2ACYP3A4NPSR1HTT
SCHEMBL5702186 0.82 NPSR1 (0.35) MEN1KMT2ACYP3A4NPSR1HTT
SCHEMBL6064223 0.79 PGK1 (0.37) CYP3A4NPSR1CYP1A2MAPTALDH1A1
SCHEMBL10517540 0.79 MEN1 (0.44) MEN1KMT2ACYP3A4NPSR1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3515447-A1 URIDINE NUCLEOSIDE DERIVATIVES, COMPOSITIONS AND METHODS OF USE Tufts University (US) 2019-07-31 EP disclosed
WO-2018058148-A1 URIDINE NUCLEOSIDE DERIVATIVES, COMPOSITIONS AND METHODS OF USE TUFTS UNIVERSITY (US) 2018-03-29 WO disclosed
EP-2451781-A1 PYRIDINE DERIVATIVES WITH UMAMI FLAVOUR Givaudan SA (CH) 2012-05-16 EP disclosed
WO-2011004016-A1 PYRIDINE DERIVATIVES WITH UMAMI FLAVOUR GIVAUDAN SA (CH) 2011-01-13 WO disclosed