SCHEMBL2830308

SCHEMBL2830308

Cc1nc2ccc(Br)cc2c2c1CCN2CCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.52
ALDH1A1 P00352 3/20 0.52
LMNA P02545 3/20 0.52
KMT2A Q03164 3/20 0.52
MAPT P10636 2/20 0.52
MITF O75030 1/20 0.44
ALPG P10696 1/20 0.44
INSR P06213 3/20 0.42
IGF1R P08069 3/20 0.42
MET P08581 3/20 0.42
ALK Q9UM73 3/20 0.42
JAK2 O60674 2/20 0.42
RXFP1 Q9HBX9 1/20 0.41
CASP3 P42574 1/20 0.40
CYP1A1 P04798 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP1B1 Q16678 1/20 0.40
MEN1 O00255 2/20 0.39
HPGD P15428 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
SCHEMBL454336 0.86 MEN1 (0.53) KDM4EKMT2AINSRIGF1RMET
SCHEMBL22448225 0.86 INSR (0.42) KDM4EALDH1A1KMT2AINSRIGF1R
SCHEMBL456887 0.86 INSR (0.42) KDM4EKMT2AINSRIGF1RMET
SCHEMBL457098 0.86 INSR (0.46) KMT2AINSRIGF1RMETALK
Hydrochloric Acid SCHEMBL2832976 0.85 INSR (0.41) KDM4EKMT2AINSRIGF1RMET
Hydrochloric Acid SCHEMBL2832650 0.85 MEN1 (0.53) KDM4EKMT2AINSRIGF1RMET
Hydrochloric Acid SCHEMBL2838059 0.84 INSR (0.45) KDM4EALDH1A1LMNAKMT2AINSR
SCHEMBL457402 0.84 KMT2A (0.52) KDM4EALDH1A1LMNAKMT2AMAPT
SCHEMBL456884 0.84 PTGER4 (0.48) KDM4EALDH1A1KMT2AINSRIGF1R
SCHEMBL2542493 0.84 CRHBP (0.42) KDM4EALDH1A1LMNAKMT2AINSR

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 7 patents. 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 disclosed
US-9694006-B2 Use of pyrroloquinoline compounds to kill clinically latent microorganisms HELPERBY THERAPEUTICS LIMITED (GB) 2017-07-04 US disclosed
EP-1945211-B1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LTD (GB) 2015-10-21 EP disclosed
US-20120231995-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LIMITED (GB) 2012-09-13 US disclosed
US-8207187-B2 Use of pyrroloquinoline compounds to kill clinically latent microorganisms HELPERBY THERAPEUTICS LIMITED (GB) 2012-06-26 US 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 (4 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 KDM4E 1494/4885ALDH1A1 865/4885LMNA 467/4885
US-20090137622-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS LPO, ARG1, CTSL KDM4E 1494/4885ALDH1A1 865/4885LMNA 467/4885
US-20120231995-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS LPO, ARG1, CTSL KDM4E 1494/4885ALDH1A1 865/4885LMNA 467/4885
US-20100093691-A1 TOPICAL FORMULATIONS DPM1, SUCLG1, LSS KDM4E 2890/4885ALDH1A1 461/4885LMNA 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.