SCHEMBL15415397

SCHEMBL15415397

COC(=O)C1(O)CCN(c2ncc(B(O)O)cn2)CC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.42
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
USP2 O75604 1/20 0.34
CYP2D6 P10635 1/20 0.34
PTPN11 Q06124 5/20 0.34
ACACB O00763 3/20 0.34
MAPT P10636 1/20 0.34
POLB P06746 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
SCHEMBL15415493 0.86 CYP3A4 (0.42) CYP3A4MEN1KMT2ATSHRHSD17B10
SCHEMBL16909548 0.85 CYP3A4 (0.44) CYP3A4MEN1KMT2ATSHRHSD17B10
SCHEMBL1282674 0.83 CYP3A4 (0.44) CYP3A4MEN1KMT2ATSHRHSD17B10
SCHEMBL15415031 0.83 CYP3A4 (0.40) CYP3A4MEN1KMT2ATSHRHSD17B10
SCHEMBL16909568 0.83 CYP3A4 (0.40) CYP3A4MEN1KMT2ATSHRHSD17B10
SCHEMBL15415398 0.80 CYP3A4 (0.41) CYP3A4MEN1KMT2ATSHRHSD17B10
SCHEMBL20606264 0.78 MEN1 (0.39) CYP3A4MEN1KMT2ATSHRHSD17B10
SCHEMBL16909354 0.78 CYP3A4 (0.36) CYP3A4MAPT
SCHEMBL16797064 0.76 MEN1 (0.38) CYP3A4MEN1KMT2AHSD17B10CYP2D6
SCHEMBL15415179 0.75 OPRM1 (0.37) CYP3A4MEN1KMT2A

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
EP-2872511-B1 IMIDAZOPYRAZINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2019-01-16 EP disclosed
EP-2872508-B1 IMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2018-08-29 EP disclosed
US-9475820-B2 Substituted imidazo[1,2-a]pyrazines as TNF activity modulators UCB BIOPHARMA SPRL (BE) 2016-10-25 US 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
US-20150191482-A1 Imidazopyrazine Derivatives as Modulators of TNF Activity UCB BIOPHARMA SPRL (BE) 2015-07-09 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 (2 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 CYP3A4 1261/4885MEN1 3644/4885KMT2A 3465/4885
US-20150191482-A1 Imidazopyrazine Derivatives as Modulators of TNF Activity TNF, TNFRSF1A, NFKBIA CYP3A4 2238/4885MEN1 3891/4885KMT2A 3823/4885

“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.