SCHEMBL17802297

SCHEMBL17802297

Cc1ccc(-n2c(C)cc(C=O)c2C)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 14/20 0.65
MAPT P10636 6/20 0.65
LMNA P02545 4/20 0.65
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65
HPGD P15428 2/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
POLB P06746 4/20 0.57
CTDSP1 Q9GZU7 3/20 0.57
L3MBTL1 Q9Y468 3/20 0.57
CASP6 P55212 2/20 0.57
KDM4E B2RXH2 2/20 0.57
HTT P42858 1/20 0.57
APEX1 P27695 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
NSD2 O96028 1/20 0.56
PKM P14618 1/20 0.56
CASP3 P42574 1/20 0.56

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
SCHEMBL21225472 0.86 ALDH1A1 (0.62) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL21225466 0.86 ALDH1A1 (0.61) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL645648 0.85 POLB (0.68) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL17802794 0.83 ALDH1A1 (0.58) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL8765504 0.83 ALDH1A1 (0.71) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL13568573 0.83 ALDH1A1 (0.65) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL13568574 0.82 NR1H4 (0.58) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL7825875 0.82 POLB (0.75) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL5150013 0.82 ALDH1A1 (0.61) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL12222500 0.81 POLB (0.67) ALDH1A1MAPTLMNAMEN1KMT2A

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3226858-B1 IMIDAZOLE-BASED ANTIMICROBIAL AGENTS PROCOMCURE BIOTECH GMBH (AT) 2021-02-03 EP disclosed
US-10456379-B2 Imidazole-based antimicrobial agents PROCOMCURE BIOTECH GMBH (AT) 2019-10-29 US disclosed
US-10322110-B2 Imidazole-based antimicrobial agents PROCOMCURE BIOTECH GMBH (AT) 2019-06-18 US disclosed
US-10314820-B2 Imidazole-based heterocyclic compounds PROCOMCURE BIOTECH GMBH (AT) 2019-06-11 US disclosed
US-20170368032-A1 Imidazole-Based Antimicrobial Agents PROCOMCURE BIOTECH GMBH (AT) 2017-12-28 US disclosed
US-20170340613-A1 Novel Imidazole-Based Heterocyclic Compounds PROCOMCURE BIOTECH GMBH (AT) 2017-11-30 US disclosed
US-20170334887-A1 Imidazole-Based Antimicrobial Agents PROCOMCURE BIOTECH GMBH (AT) 2017-11-23 US disclosed
EP-3226858-A1 IMIDAZOLE-BASED ANTIMICROBIAL AGENTS Procomcure Biotech GmbH (AT) 2017-10-11 EP disclosed
WO-2016087618-A1 IMIDAZOLE-BASED ANTIMICROBIAL AGENTS PROCOMCURE BIOTECH GMBH (AT) 2016-06-09 WO disclosed
WO-2016087616-A1 IMIDAZOLE-BASED ANTIMICROBIAL AGENTS PROCOMCURE BIOTECH GMBH (AT) 2016-06-09 WO disclosed
WO-2016087615-A1 NOVEL IMIDAZOLE-BASED HETEROCYCLIC COMPOUNDS PROCOMCURE BIOTECH GMBH (AT) 2016-06-09 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 (6 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-20170334887-A1 Imidazole-Based Antimicrobial Agents TLR5, NISCH, SLC11A2 ALDH1A1 1629/4885MAPT 1161/4885LMNA 4548/4885
US-10456379-B2 Imidazole-based antimicrobial agents TLR5, NISCH, SLC11A2 ALDH1A1 1629/4885MAPT 1161/4885LMNA 4548/4885
US-10322110-B2 Imidazole-based antimicrobial agents ARG1, SLC11A2, IKZF3 ALDH1A1 1211/4885MAPT 4173/4885LMNA 4362/4885
US-20170368032-A1 Imidazole-Based Antimicrobial Agents TLR5, NISCH, SLC11A2 ALDH1A1 1629/4885MAPT 1161/4885LMNA 4548/4885
US-20170340613-A1 Novel Imidazole-Based Heterocyclic Compounds SLC11A2, MIF, NISCH ALDH1A1 562/4885MAPT 2113/4885LMNA 4273/4885
US-10314820-B2 Imidazole-based heterocyclic compounds MIF, SLC11A2, TLR5 ALDH1A1 370/4885MAPT 1610/4885LMNA 4294/4885

“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.