SCHEMBL455329

SCHEMBL455329

COc1cc(OC)c2nc(C)c3c(c2c1)N(CCC(C)C)CC3

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
LMNA P02545 2/20 0.58
RAD52 P43351 2/20 0.58
POLB P06746 1/20 0.58
CYP1A2 P05177 3/20 0.57
GAA P10253 3/20 0.57
MEN1 O00255 2/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2D6 P10635 2/20 0.57
CYP2C19 P33261 2/20 0.57
JAK2 O60674 1/20 0.57
PDE5A O76074 2/20 0.43
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 2/20 0.43
NPC1 O15118 1/20 0.43
CYP1A1 P04798 1/20 0.40
CYP1B1 Q16678 1/20 0.40
GLA P06280 1/20 0.39
HTT P42858 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
Formic Acid SCHEMBL2830842 0.94 KMT2A (0.53) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL2546153 0.82 KMT2A (0.58) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL457184 0.81 KMT2A (0.57) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL454328 0.81 KMT2A (0.59) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL453683 0.79 KMT2A (0.63) KMT2ASMN1; SMN2LMNARAD52POLB
Formic Acid SCHEMBL2834599 0.77 KMT2A (0.52) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL454054 0.74 KMT2A (0.63) KMT2ASMN1; SMN2LMNARAD52POLB
Formic Acid SCHEMBL2830736 0.74 KMT2A (0.57) KMT2ASMN1; SMN2LMNARAD52POLB
Trifluoroacetic Acid SCHEMBL2832867 0.74 KMT2A (0.49) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL2575119 0.74 KMT2A (0.82) KMT2ASMN1; SMN2LMNARAD52POLB

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170258784-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LIMITED (GB) 2017-09-14 US claimed
US-9694006-B2 Use of pyrroloquinoline compounds to kill clinically latent microorganisms HELPERBY THERAPEUTICS LIMITED (GB) 2017-07-04 US claimed
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
US-20120231995-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LIMITED (GB) 2012-09-13 US claimed
WO-2011121345-A1 NOVEL COMBINATION AND USE HELPERBY THERAPEUTICS LIMITED (GB) 2011-10-06 WO claimed
US-20100093691-A1 TOPICAL FORMULATIONS HELPERBY THERAPEUTICS LIMITED (GB) 2010-04-15 US claimed
US-20090137622-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LIMITED (GB) 2009-05-28 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-20170258784-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LIMITED (GB) 2017-09-14 US 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
US-20100093691-A1 TOPICAL FORMULATIONS HELPERBY THERAPEUTICS LIMITED (GB) 2010-04-15 US disclosed
EP-2086542-A1 TOPICAL FORMULATIONS Helperby Therapeutics Limited (GB) 2009-08-12 EP disclosed
US-20090137622-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LIMITED (GB) 2009-05-28 US disclosed
WO-2008056151-A1 TOPICAL FORMULATIONS HELPERBY THERAPEUTICS LIMITED (GB) 2008-05-15 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 (5 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-20170258784-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS LPO, ARG1, CTSL KMT2A 2403/4885SMN1; SMN2 4384/4885LMNA 467/4885
US-20130096151-A1 NOVEL COMBINATION AND USE FPR2, LTA, FPR1 KMT2A 2810/4885SMN1; SMN2 4040/4885LMNA 2794/4885
US-20090137622-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS LPO, ARG1, CTSL KMT2A 2403/4885SMN1; SMN2 4384/4885LMNA 467/4885
US-20120231995-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS LPO, ARG1, CTSL KMT2A 2403/4885SMN1; SMN2 4384/4885LMNA 467/4885
US-20100093691-A1 TOPICAL FORMULATIONS DPM1, SUCLG1, LSS KMT2A 4302/4885SMN1; SMN2 4584/4885LMNA 1655/4885

“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.