SCHEMBL15416062

SCHEMBL15416062

COC(=O)C12CC1CN(Cc1ccccc1)C2

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.44
ALDH1A1 P00352 1/20 0.44
NR3C1 P04150 1/20 0.43
S1PR1 P21453 1/20 0.42
S1PR5 Q9H228 1/20 0.42
BCHE P06276 4/20 0.41
GAA P10253 1/20 0.41
MAOB P27338 1/20 0.41
MCHR1 Q99705 1/20 0.41
ACHE P22303 1/20 0.40
SIGMAR1 Q99720 1/20 0.40

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
SCHEMBL31254224 0.87 CYP3A4 (0.49) CYP2D6ALDH1A1GAASIGMAR1
SCHEMBL3228019 0.87 CYP3A4 (0.49) CYP2D6ALDH1A1GAASIGMAR1
SCHEMBL13537596 0.87 CYP3A4 (0.49) CYP2D6ALDH1A1GAASIGMAR1
SCHEMBL14367739 0.85 CYP2D6 (0.46) CYP2D6ALDH1A1BCHEMAOBMCHR1
SCHEMBL2670100 0.85 CYP2D6 (0.46) CYP2D6ALDH1A1BCHEMAOBMCHR1
SCHEMBL2670096 0.85 CYP2D6 (0.46) CYP2D6ALDH1A1BCHEMAOBMCHR1
SCHEMBL1282150 0.85 CYP2D6 (0.46) CYP2D6ALDH1A1BCHEMAOBMCHR1
SCHEMBL3259925 0.85 S1PR1 (0.47) ALDH1A1S1PR1S1PR5BCHEGAA
SCHEMBL4487651 0.85 S1PR1 (0.47) ALDH1A1S1PR1S1PR5BCHEGAA
SCHEMBL3228487 0.85 S1PR1 (0.47) ALDH1A1S1PR1S1PR5BCHEGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2872508-B1 IMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2018-08-29 EP disclosed
US-9309243-B2 Imidazopyridine derivatives as modulators of TNF activity UCB BIOPHARMA SPRL (BE) 2016-04-12 US disclosed
US-20150203486-A1 Imidazopyridine Derivatives as Modulators of TNF Activity UCB Biopharma SPRL a corporation 2015-07-23 US disclosed
EP-2872508-A1 IMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SPRL (BE) 2015-05-20 EP disclosed
WO-2014009295-A1 IMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB PHARMA S.A. (BE) 2014-01-16 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-20150203486-A1 Imidazopyridine Derivatives as Modulators of TNF Activity TNF, TNFRSF1A, IL1A CYP2D6 1028/4885ALDH1A1 297/4885NR3C1 1543/4885

“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.