SCHEMBL9799201

SCHEMBL9799201

CON(C)C(=O)Nc1ccc(CCCc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.53
FFAR1 O14842 2/20 0.53
HDAC1 Q13547 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
TP53 P04637 1/20 0.49
CNR1 P21554 1/20 0.48
MTOR P42345 1/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TDP1 Q9NUW8 2/20 0.46
PKM P14618 1/20 0.46
RAB9A P51151 1/20 0.46
HTT P42858 2/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL9799171 0.92 TP53 (0.56) FFAR4FFAR1HDAC1HDAC8TP53
SCHEMBL11115368 0.83 RAB9A (0.57) HDAC1HDAC8MEN1KMT2AMAPT
SCHEMBL11043291 0.81 SIRT2 (0.57) TP53MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL11106844 0.81 NR1H4 (0.47) MEN1KMT2AMAPTSMN1; SMN2TDP1
SCHEMBL11230891 0.81 TP53 (0.56) TP53MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL11107806 0.80 KMT2A (0.49) FFAR1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL11109670 0.79 RAB9A (0.46) FFAR1TP53MEN1KMT2AMAPT
SCHEMBL11273389 0.79 TLR8 (0.56) TP53MEN1KMT2AMAPTTDP1
SCHEMBL9799292 0.78 PKM (0.59) TP53CNR1MEN1KMT2AMAPT
SCHEMBL11111401 0.78 KMT2A (0.57) FFAR1CNR1MEN1KMT2AMAPT

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
US-5015762-A Alkoxy substituted ureas as herbicides BASF AKTIENGESELLSCHAFT (DE) 1991-05-14 US claimed