SCHEMBL7677475

SCHEMBL7677475

Cc1c(SCCSCc2cccnc2)ccnc1CNc1cnc2ccccc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
RAB9A P51151 5/20 0.39
NPC1 O15118 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 3/20 0.39
HTT P42858 3/20 0.39
LMNA P02545 2/20 0.39
GFER P55789 1/20 0.39
DHFR P00374 1/20 0.38
NAMPT P43490 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
TSHR P16473 1/20 0.37
MAPT P10636 3/20 0.37
GAA P10253 2/20 0.37
NFKB1 P19838 2/20 0.37
NFKB2 Q00653 2/20 0.37
RELA Q04206 2/20 0.37

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
SCHEMBL7669698 0.91 FLT1 (0.43) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL7675572 0.86 FLT1 (0.42) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL7675307 0.86 FLT1 (0.42) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL7675316 0.85 ALDH1A1 (0.40) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL7675280 0.82 ALDH1A1 (0.38) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL7679446 0.82 MEN1 (0.46) MEN1KMT2ARAB9ANPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL7677732 0.81 MEN1 (0.45) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL7670964 0.81 MEN1 (0.45) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL7675999 0.80 MEN1 (0.40) MEN1KMT2ARAB9ANPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL7672407 0.80 MEN1 (0.44) MEN1KMT2ARAB9ANPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6479514-B1 FOR THE CONTROL OF HELICOBACTER BACTERIA IN INFECTED PATIENTS ALTANA PHARMA AG (DE) 2002-11-12 US disclosed
EP-1086094-A1 QUINOLINE-AMINOMETHYL-PYRIDYL DERIVATIVES WITH ANTI-HELICOBACTER ACTIVITY Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2001-03-28 EP disclosed
WO-1999061438-A1 QUINOLINE-AMINOMETHYL-PYRIDYL DERIVATIVES WITH ANTI-HELICOBACTER ACTIVITY BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1999-12-02 WO disclosed