SCHEMBL20764314

SCHEMBL20764314

N/C(=C\c1cccc2c1CCN2C(=O)c1cc2cc(N)ccc2[nH]1)C(=O)N1CCc2c1ccc1[nH]c(C(=O)O)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
RXFP1 Q9HBX9 2/20 0.40
HRH4 Q9H3N8 3/20 0.39
NGFR P08138 1/20 0.35
ABCB1 P08183 1/20 0.33
POLB P06746 1/20 0.33
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP1B1 Q16678 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SMAD3 P84022 1/20 0.31
KIF11 P52732 1/20 0.31

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
SCHEMBL20764301 0.90 KIF11 (0.37) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL20764163 0.88 NPC1 (0.40) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL20764181 0.86 HRH4 (0.50) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL20764300 0.86 BTK (0.34) RAB9AHRH4NGFRPOLBKDM4E
SCHEMBL20764325 0.79 MAPT (0.37) NPC1RAB9APOLBMAPTLMNA
SCHEMBL889826 0.76 KMT2A (0.40) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL20764411 0.75 BTK (0.35) RAB9AHRH4POLBMAPTKDM4E
SCHEMBL20764330 0.74 BTK (0.34) POLBLMNAKIF11BAZ2B
SCHEMBL20764323 0.73 HRH4 (0.46) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL13183210 0.73 RAB9A (0.41) NPC1RAB9AMEN1KMT2ARXFP1

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-2019036225-A1 DUPLEX STABILIZING FLUORESCENCE QUENCHERS FOR NUCLEIC ACID PROBES ELITECHGROUP, INC. (US) 2019-02-21 WO disclosed