SCHEMBL16909461

SCHEMBL16909461

COC(=O)C1CCN(c2ncc(-c3ccc4nc(C)c(Cc5ccccc5OC(F)F)n4c3)c(OC)n2)CC1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALKBH1 Q13686 1/20 0.36
GPR6 P46095 1/20 0.36
EPHX2 P34913 2/20 0.35
PTPN11 Q06124 1/20 0.34
TNF P01375 1/20 0.34
ALDH1A1 P00352 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
KDM4E B2RXH2 1/20 0.34
SLC2A1 P11166 3/20 0.33
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL16909782 0.94 ALKBH1 (0.38) ALKBH1GPR6EPHX2TNFALDH1A1
SCHEMBL16909751 0.88 TNF (0.39) ALKBH1EPHX2PTPN11TNFALDH1A1
SCHEMBL16909569 0.84 GPR6 (0.33) ALKBH1GPR6TNFSLC2A1
SCHEMBL16909840 0.83 KDM4E (0.38) ALKBH1GPR6EPHX2PTPN11TNF
SCHEMBL16909640 0.83 ALKBH1 (0.41) ALKBH1EPHX2TNFALDH1A1RXFP1
SCHEMBL16909380 0.82 KDM4E (0.38) ALKBH1EPHX2TNFALDH1A1RXFP1
SCHEMBL16909411 0.81 TNF (0.37) ALKBH1EPHX2TNFALDH1A1RXFP1
SCHEMBL17666760 0.80 TNF (0.40) ALKBH1EPHX2TNFKDM4ESLC2A1
SCHEMBL16909897 0.80 TNF (0.42) ALKBH1TNFALDH1A1KDM4ESLC2A1
SCHEMBL20478090 0.80 TNF (0.41) ALKBH1TNFSLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9309243-B2 Imidazopyridine derivatives as modulators of TNF activity UCB BIOPHARMA SPRL (BE) 2016-04-12 US claimed
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

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 ALKBH1 4341/4885GPR6 837/4885EPHX2 3133/4885

“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.