SCHEMBL12075162

SCHEMBL12075162

CCc1ccccc1/C=C/C(C)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.61
MAPT P10636 2/20 0.61
KDM4E B2RXH2 2/20 0.56
IAPP P10997 3/20 0.53
GLA P06280 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
PTGER3 P43115 7/20 0.46
PTGER2 P43116 7/20 0.46
PTGER4 P35408 5/20 0.46
TBXA2R P21731 4/20 0.44
PTGDR Q13258 4/20 0.44
KMT2A Q03164 1/20 0.43
ATM Q13315 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43

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
SCHEMBL26046363 0.87 LMNA (0.59) LMNAMAPTKDM4EIAPPGLA
SCHEMBL15630767 0.85 LMNA (0.58) LMNAMAPTKDM4EIAPPGLA
SCHEMBL3214322 0.85 PTGER3 (0.63) MAPTPTGER3PTGER2PTGER4TBXA2R
SCHEMBL1150939 0.85 PTGER3 (0.63) MAPTPTGER3PTGER2PTGER4TBXA2R
SCHEMBL309761 0.85 PTGER3 (0.63) MAPTPTGER3PTGER2PTGER4TBXA2R
SCHEMBL9725168 0.84 LMNA (0.53) LMNAMAPTKDM4EIAPPGLA
SCHEMBL14441077 0.83 MAPT (0.76) LMNAMAPTKDM4EIAPPGLA
SCHEMBL27680267 0.83 PTGER3 (0.45) LMNAMAPTKDM4EIAPPPTGER3
SCHEMBL27667797 0.83 PTGER3 (0.45) LMNAMAPTKDM4EIAPPPTGER3
SCHEMBL5695994 0.82 LMNA (0.54) LMNAMAPTKDM4EIAPPGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9447090-B2 Imidazopyridine compounds ASTELLAS PHARMA INC. (JP) 2016-09-20 US disclosed
US-20140088080-A1 IMIDAZOPYRIDINE COMPOUNDS ASTELLAS PHARMA INC. (JP) 2014-03-27 US disclosed
EP-2144889-B1 QUINAZOLIN-OXIME DERIVATIVES AS HSP90 INHIBITORS DAC SRL (IT) 2012-08-29 EP disclosed
US-7314879-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2008-01-01 US disclosed
US-7291619-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-11-06 US disclosed
US-7186715-B2 Piperazine- and piperidine-derivatives as melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-03-06 US disclosed
US-7169777-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-30 US disclosed
US-7157463-B2 Substituted piperidines/piperazines as melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-02 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 (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-20140088080-A1 IMIDAZOPYRIDINE COMPOUNDS GUCY1A1, PDE2A, GUCY1A2 LMNA 1848/4885MAPT 4789/4885KDM4E 965/4885

“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.