SCHEMBL712059

SCHEMBL712059

CC(C)Oc1cc(OCc2ccccc2)ccc1-c1nc2cc(-c3ccc(F)cc3)cnc2[nH]1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.40
MAPT P10636 7/20 0.39
MAPK1 P28482 5/20 0.39
KDM4E B2RXH2 4/20 0.39
NPSR1 Q6W5P4 4/20 0.39
POLB P06746 1/20 0.39
PTPN1 P18031 2/20 0.38
GPR34 Q9UPC5 1/20 0.38
CYP1A1 P04798 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP1B1 Q16678 1/20 0.37
NOD2 Q9HC29 1/20 0.37
MAPK14 Q16539 1/20 0.36
CHEK2 O96017 1/20 0.36
PDGFRB P09619 1/20 0.36
PDGFRA P16234 1/20 0.36
HSP90AA1 P07900 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
PRMT5 O14744 1/20 0.36
MMP1 P03956 1/20 0.35

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
SCHEMBL10206529 0.94 MAPT (0.41) MCL1MAPTMAPK1KDM4ENPSR1
SCHEMBL711592 0.93 MCL1 (0.40) MCL1MAPTMAPK1KDM4ENPSR1
SCHEMBL711273 0.92 GPR34 (0.40) MCL1MAPTMAPK1KDM4ENPSR1
SCHEMBL720489 0.92 MAPT (0.46) MCL1MAPTMAPK1KDM4ENPSR1
SCHEMBL712826 0.91 MAP4K4 (0.43) MCL1MAPTMAPK1NPSR1GPR34
SCHEMBL709187 0.90 MAPT (0.36) MCL1MAPTMAPK1KDM4ENPSR1
SCHEMBL720491 0.89 MAPT (0.46) MAPTMAPK1KDM4ENPSR1POLB
Trifluoroacetic Acid SCHEMBL710810 0.88 MCL1 (0.41) MCL1MAPTMAPK1KDM4ENPSR1
SCHEMBL713547 0.88 PRMT5 (0.39) MCL1MAPTMAPK1KDM4ENPSR1
SCHEMBL710291 0.87 FFAR1 (0.37) MCL1MAPTMAPK1KDM4ENPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1940837-B1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA PHARMACEUTICAL (JP) 2012-11-07 EP disclosed
US-8124617-B2 Imidazopyridine compounds TAKEDA SAN DIEGO, INC. (US) 2012-02-28 US disclosed
US-8124617-B2 Imidazopyridine compounds TAKEDA SAN DIEGO, INC. (US) 2012-02-28 US disclosed
US-8124617-B2 Imidazopyridine compounds TAKEDA SAN DIEGO, INC. (US) 2012-02-28 US disclosed
US-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA SAN DIEGO, INC. 2010-03-18 US disclosed
US-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA SAN DIEGO, INC. 2010-03-18 US disclosed
US-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA SAN DIEGO, INC. 2010-03-18 US disclosed
EP-1940837-A2 IMIDAZOPYRIDINE COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2008-07-09 EP disclosed
WO-2007028135-A2 IMIDAZOPYRIDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-08 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-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS GCK, GCKR, KHK MCL1 4054/4885MAPT 3003/4885MAPK1 863/4885

“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.