SCHEMBL28174998

SCHEMBL28174998

NC(=O)Cc1ccc(-c2ccccc2)c(O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.51
NFKB1 P19838 2/20 0.51
NPC1 O15118 1/20 0.51
STAT1 P42224 1/20 0.51
RAB9A P51151 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
ALOX5 P09917 1/20 0.48
CA2 P00918 1/20 0.48
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
BACE1 P56817 2/20 0.46
HSD17B10 Q99714 2/20 0.46
LMNA P02545 2/20 0.46
GAA P10253 2/20 0.46
TSHR P16473 2/20 0.46
RGS12 O14924 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
APEX1 P27695 1/20 0.46

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
SCHEMBL31225239 0.86 GAA (0.63) HPGDNFKB1ALOX5CA2KDM4E
SCHEMBL27854362 0.83 FFAR4 (0.46) HPGDNFKB1NPC1STAT1RAB9A
SCHEMBL1815685 0.80 CYP1A2 (0.50) HPGDNFKB1NPC1STAT1RAB9A
SCHEMBL9207785 0.79 GAA (0.56) HPGDNFKB1NPC1RAB9ANFKB2
SCHEMBL2807447 0.78 CSNK2A1 (0.65) HPGDALOX5ALDH1A1BACE1HSD17B10
SCHEMBL2734611 0.77 KDM4E (0.67) HPGDNFKB1CA2KDM4EALDH1A1
SCHEMBL14832184 0.77 ALOX5 (0.59) HPGDALOX5ALDH1A1BACE1HSD17B10
SCHEMBL1395755 0.77 LMNA (0.69) HPGDNFKB1NPC1STAT1RAB9A
SCHEMBL254913 0.77 RORC (0.54) HPGDNFKB1NPC1STAT1RAB9A
Hydrochloric Acid SCHEMBL21382514 0.76 LMNA (0.67) HPGDNFKB1NPC1STAT1RAB9A

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
CN-104024259-B It is used as the triazolopyridazine derivates of 6 substitutions of Rev Erb activators 基恩菲特公司 2017-09-26 CN disclosed