SCHEMBL454548

SCHEMBL454548

Cc1cc(Nc2nc3ccccc3n2C)c2cc(Cl)cc(Cl)c2n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.51
RAB9A P51151 4/20 0.46
TP53 P04637 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 3/20 0.46
LMNA P02545 2/20 0.46
KMT2A Q03164 3/20 0.43
PDE10A Q9Y233 1/20 0.43
MAPT P10636 3/20 0.41
HTT P42858 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CRHR1 P34998 2/20 0.40
ALDH1A1 P00352 2/20 0.39
AKT1 P31749 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
SCHEMBL457180 0.84 GAA (0.57) GAARAB9ATP53SMN1; SMN2NPC1
Hydrochloric Acid SCHEMBL4747848 0.83 GAA (0.56) GAARAB9ATP53SMN1; SMN2NPC1
Hydrochloric Acid SCHEMBL454389 0.81 GAA (0.56) GAARAB9ATP53SMN1; SMN2NPC1
SCHEMBL458153 0.76 GAA (0.50) GAARAB9ATP53SMN1; SMN2NPC1
Hydrochloric Acid SCHEMBL4748983 0.75 GAA (0.49) GAARAB9ATP53SMN1; SMN2NPC1
SCHEMBL455475 0.75 GAA (0.50) GAARAB9ATP53SMN1; SMN2NPC1
SCHEMBL457327 0.74 GAA (0.53) GAARAB9ATP53SMN1; SMN2NPC1
SCHEMBL3921729 0.73 GAA (0.78) GAARAB9ATP53SMN1; SMN2NPC1
SCHEMBL454957 0.72 PTPN11 (0.50) GAARAB9ATP53SMN1; SMN2NPC1
SCHEMBL456542 0.72 LMNA (0.46) GAARAB9ATP53SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130096151-A1 NOVEL COMBINATION AND USE HELPERBY THERAPEUTICS LIMITED (GB) 2013-04-18 US claimed
EP-2552440-A1 NOVEL COMBINATION AND USE Helperby Therapeutics Limited (GB) 2013-02-06 EP claimed
WO-2011121345-A1 NOVEL COMBINATION AND USE HELPERBY THERAPEUTICS LIMITED (GB) 2011-10-06 WO claimed
WO-2008117079-A1 ANTIMICROBIAL COMPOUNDS BASED UPON 4-AMINOQUINOLINE HELPERBY THERAPEUTICS LIMITED (GB) 2008-10-02 WO claimed
EP-3228314-B1 SULOCTIDIL FOR USE TO TREAT MICROBIAL INFECTIONS HELPERBY THERAPEUTICS LTD (GB) 2020-11-04 EP disclosed
US-10265373-B2 Pharmaceutical composition and method of treating a microbial infection with sulcotidil HELPERBY THERAPEUTICS LIMITED (GB) 2019-04-23 US disclosed
WO-2018162928-A1 METHOD FOR RESTORING EFFICACY OF AN ANTIBACTERIAL AGENT HELPERBY THERAPEUTICS LIMITED (GB) 2018-09-13 WO disclosed
US-9789101-B2 Methods and compositions for treating microbial infection using pyrroloquinone HELPERBY THERAPEUTICS LIMITED (GB) 2017-10-17 US disclosed
EP-3228314-A1 VASODILATOR FOR USE TO TREAT MICROBIAL INFECTIONS Helperby Therapeutics Limited (GB) 2017-10-11 EP disclosed
US-9549965-B2 Pharmaceutical composition for treating a microbial infection HELPERBY THERAPEUTICS LIMITED (GB) 2017-01-24 US disclosed
US-20160082073-A1 NOVEL USE HELPERBY THERAPEUTICS LIMITED (GB) 2016-03-24 US disclosed
US-20130243886-A1 NOVEL USE HELPERBY THERAPEUTICS LIMITED (GB) 2013-09-19 US disclosed
EP-2613774-A2 NOVEL USE Helperby Therapeutics Limited (GB) 2013-07-17 EP disclosed
US-20130096151-A1 NOVEL COMBINATION AND USE HELPERBY THERAPEUTICS LIMITED (GB) 2013-04-18 US disclosed
EP-2552440-A1 NOVEL COMBINATION AND USE Helperby Therapeutics Limited (GB) 2013-02-06 EP disclosed
WO-2012032360-A2 NOVEL USE HELPERBY THERAPEUTICS LIMITED (GB) 2012-03-15 WO disclosed
WO-2011121345-A1 NOVEL COMBINATION AND USE HELPERBY THERAPEUTICS LIMITED (GB) 2011-10-06 WO disclosed
WO-2008117079-A1 ANTIMICROBIAL COMPOUNDS BASED UPON 4-AMINOQUINOLINE HELPERBY THERAPEUTICS LIMITED (GB) 2008-10-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130096151-A1 NOVEL COMBINATION AND USE FPR2, LTA, FPR1 GAA 1415/4885RAB9A 4299/4885TP53 2121/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.