SCHEMBL455475

SCHEMBL455475

Cc1cc(Nc2nc3ccccc3n2C)c2cc(O)ccc2n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.50
HPGD P15428 3/20 0.50
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
GLA P06280 1/20 0.50
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
LMNA P02545 2/20 0.49
TP53 P04637 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KDR P35968 2/20 0.44
PLK1 P53350 2/20 0.44
PTK2 Q05397 2/20 0.44
AURKB Q96GD4 2/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
ALOX15 P16050 1/20 0.44

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 0.85 GAA (0.57) GAAHPGDKDM4ENPC1RAB9A
Hydrochloric Acid SCHEMBL4747848 0.84 GAA (0.56) GAAHPGDKDM4ENPC1RAB9A
SCHEMBL457327 0.84 GAA (0.53) GAANPC1RAB9AL3MBTL1LMNA
SCHEMBL454957 0.82 PTPN11 (0.50) GAANPC1RAB9ALMNATP53
SCHEMBL456542 0.82 LMNA (0.46) GAAHPGDKDM4ENPC1RAB9A
Hydrochloric Acid SCHEMBL4747208 0.81 LMNA (0.45) GAAHPGDKDM4ENPC1RAB9A
SCHEMBL457343 0.81 TP53 (0.52) NPC1RAB9ALMNATP53SMN1; SMN2
SCHEMBL2543132 0.79 ADRA2A (0.64) GLATDP1
SCHEMBL455066 0.78 PTPN11 (0.49) NPC1RAB9ALMNATP53SMN1; SMN2
SCHEMBL454499 0.78 PTPN11 (0.49) GAANPC1RAB9ALMNATP53

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 1415/4885HPGD 2334/4885KDM4E 3298/4885

“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.