SCHEMBL16909366

SCHEMBL16909366

O=C(O)C1CCN(c2ncc(B(O)O)cn2)CCO1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
KDM4E B2RXH2 5/20 0.42
HSD17B10 Q99714 2/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.41
RIPK1 Q13546 2/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ADRA1A P35348 1/20 0.33
NEK2 P51955 1/20 0.33
HTT P42858 1/20 0.32
PDK1 Q15118 1/20 0.31
KDM1A O60341 1/20 0.31
PTPN11 Q06124 1/20 0.31
GPR119 Q8TDV5 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
PRKAB2 O43741 1/20 0.31
PRKAG1 P54619 1/20 0.31

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
SCHEMBL16909401 0.88 POLB (0.41) POLBKDM4EHSD17B10ALDH1A1TSHR
SCHEMBL15414731 0.88 POLB (0.41) POLBKDM4EHSD17B10ALDH1A1TSHR
SCHEMBL15415151 0.80 KDM4E (0.64) POLBKDM4EHSD17B10TSHRCYP2C19
Hydrochloric Acid SCHEMBL20478088 0.79 HSD11B1 (0.35) POLBKDM4EHSD17B10ALDH1A1TSHR
SCHEMBL5525017 0.75 POLB (0.57) POLBKDM4EHSD17B10ALDH1A1TSHR
SCHEMBL18150782 0.74 SMO (0.40) POLBKDM4ECYP2C19HTTGPR119
SCHEMBL20606306 0.72 WDR5 (0.38) POLBADRA1A
SCHEMBL20606305 0.72 WDR5 (0.38) POLBADRA1A
SCHEMBL20606546 0.72 WDR5 (0.38) POLBADRA1A
SCHEMBL3945544 0.71 POLB (0.42) POLBALDH1A1TSHRCYP2C19USP2

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 3 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

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 POLB 2176/4885KDM4E 4217/4885HSD17B10 4434/4885

“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.