SCHEMBL454484

SCHEMBL454484

COc1cc(OC)c2nc(C)c3c(c2c1)N(c1cccc(Oc2ccccc2)c1)CC3

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.72
SMN1; SMN2 Q16637 2/20 0.72
LMNA P02545 2/20 0.72
RAD52 P43351 2/20 0.72
POLB P06746 1/20 0.72
GAA P10253 3/20 0.68
MEN1 O00255 3/20 0.68
CYP1A2 P05177 3/20 0.68
CYP3A4 P08684 2/20 0.68
CYP2D6 P10635 2/20 0.68
CYP2C19 P33261 2/20 0.68
KDM4E B2RXH2 3/20 0.65
GLA P06280 1/20 0.65
HTT P42858 1/20 0.65
JAK2 O60674 1/20 0.64
ALDH1A1 P00352 2/20 0.60
NPC1 O15118 1/20 0.60
CYP1A1 P04798 1/20 0.44
CYP1B1 Q16678 1/20 0.44
PIK3CA P42336 1/20 0.41

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
SCHEMBL2542489 0.93 KMT2A (0.84) KMT2ASMN1; SMN2LMNARAD52POLB
Trifluoroacetic Acid SCHEMBL2834712 0.92 KMT2A (0.61) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL454338 0.87 KMT2A (0.79) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL2837570 0.86 KMT2A (0.69) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL454208 0.85 KMT2A (0.68) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL462532 0.84 KMT2A (0.74) KMT2ASMN1; SMN2LMNARAD52POLB
Formic Acid SCHEMBL2837568 0.82 KMT2A (0.72) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL457100 0.82 KDM4E (0.83) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL2545077 0.82 KMT2A (0.64) KMT2ASMN1; SMN2LMNARAD52POLB
SCHEMBL456143 0.81 KMT2A (1.00) 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 31 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
EP-2086542-A1 TOPICAL FORMULATIONS Helperby Therapeutics Limited (GB) 2009-08-12 EP claimed
US-20090137622-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LIMITED (GB) 2009-05-28 US claimed
EP-1945211-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS Helperby Therapeutics Limited (GB) 2008-07-23 EP claimed
WO-2008056151-A1 TOPICAL FORMULATIONS HELPERBY THERAPEUTICS LIMITED (GB) 2008-05-15 WO claimed
WO-2007054693-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LIMITED (GB) 2007-05-18 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
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
US-20090137622-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LIMITED (GB) 2009-05-28 US 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.