SCHEMBL455066

SCHEMBL455066

Cc1cc(Nc2nc3ccccc3n2C)c2cc(Oc3ccc(F)cc3)ccc2n1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.49
NPC1 O15118 5/20 0.48
RAB9A P51151 4/20 0.48
TP53 P04637 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 2/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
GPR35 Q9HC97 1/20 0.47
POLB P06746 1/20 0.45
RAD52 P43351 1/20 0.45
NQO2 P16083 2/20 0.44
UBE2N P61088 1/20 0.44
TLR9 Q9NR96 1/20 0.44
PKM P14618 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
PDE10A Q9Y233 2/20 0.42
SLC2A1 P11166 1/20 0.42

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
Formic Acid SCHEMBL4786385 0.94 PTPN11 (0.44) PTPN11NPC1RAB9ATP53SMN1; SMN2
SCHEMBL454957 0.93 PTPN11 (0.50) PTPN11NPC1RAB9ATP53SMN1; SMN2
SCHEMBL454499 0.85 PTPN11 (0.49) PTPN11NPC1RAB9ATP53SMN1; SMN2
SCHEMBL457343 0.81 TP53 (0.52) PTPN11NPC1RAB9ATP53SMN1; SMN2
SCHEMBL4748264 0.81 ERBB2 (0.53) NPC1RAB9ATP53SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL4748017 0.80 ERBB2 (0.52) NPC1RAB9ATP53SMN1; SMN2LMNA
SCHEMBL457180 0.78 GAA (0.57) NPC1RAB9ATP53SMN1; SMN2LMNA
SCHEMBL455475 0.78 GAA (0.50) NPC1RAB9ATP53SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL4747848 0.78 GAA (0.56) NPC1RAB9ATP53SMN1; SMN2LMNA
SCHEMBL457327 0.78 GAA (0.53) NPC1RAB9ATP53SMN1; SMN2LMNA

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 14 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-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

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 PTPN11 4007/4885NPC1 4098/4885RAB9A 4299/4885

“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.