SCHEMBL7437271

SCHEMBL7437271

CCCN(CO)c1ccccc1C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.46
MAPT P10636 3/20 0.44
CYP3A4 P08684 2/20 0.44
MEN1 O00255 1/20 0.44
NR1I2 O75469 1/20 0.44
LMNA P02545 1/20 0.44
CHRM2 P08172 1/20 0.44
ADRA2A P08913 1/20 0.44
OPRK1 P41145 1/20 0.44
HTR2B P41595 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KMT2A Q03164 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
BCAT2 O15382 1/20 0.40
TSHR P16473 5/20 0.39
ALDH1A1 P00352 5/20 0.39
HSD17B10 Q99714 3/20 0.39
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
LTB4R2 Q9NPC1 1/20 0.39

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
SCHEMBL335962 0.81 MAPT (0.45) TP53MAPTCYP3A4MEN1NR1I2
SCHEMBL10613988 0.80 TP53 (0.49) TP53MAPTCYP3A4MEN1NR1I2
SCHEMBL6569152 0.78 TSHR (0.57) TP53MAPTCYP3A4MEN1KMT2A
SCHEMBL11667952 0.76 LMNA (0.50) TP53MAPTCYP3A4MEN1NR1I2
SCHEMBL4086031 0.76 TP53 (0.52) TP53MEN1KMT2ATSHRALDH1A1
SCHEMBL959111 0.75 CTSD (0.47) TP53MAPTMEN1LMNAKMT2A
SCHEMBL2212947 0.75 TP53 (0.44) TP53MAPTCYP3A4MEN1NR1I2
SCHEMBL20133760 0.75 TP53 (0.42) TP53MAPTCYP3A4MEN1NR1I2
SCHEMBL11144881 0.74 TSHR (0.45) TP53MAPTCYP3A4MEN1NR1I2
SCHEMBL341842 0.74 TP53 (0.46) TP53TSHRALDH1A1KDM4EGAA

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-2001030745-A1 ANTHRANILIC ACID DERIVATIVES AS INHIBITORS OF THE CGMP-PHOSPHODIESTERASE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-03 WO disclosed