SCHEMBL1994602

SCHEMBL1994602

COc1nc(-c2cnc3ccc(C#N)cn23)ncc1-c1cccnc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 5/20 0.42
JAK3 P52333 5/20 0.42
FYN P06241 3/20 0.42
JAK1 P23458 3/20 0.39
SQOR Q9Y6N5 1/20 0.39
PIK3CA P42336 1/20 0.39
MTOR P42345 1/20 0.39
EIF2AK4 Q9P2K8 3/20 0.39
FGFR1 P11362 1/20 0.38
CYP11B2 P19099 2/20 0.38
FLT3 P36888 2/20 0.38
IRAK1 P51617 2/20 0.38
IRAK4 Q9NWZ3 2/20 0.38
NRAS P01111 1/20 0.38
LCK P06239 1/20 0.38
RET P07949 1/20 0.38
PDGFRB P09619 1/20 0.38
CDK7 P50613 1/20 0.38
CCNH P51946 1/20 0.38
CYP11B1 P15538 1/20 0.37

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
SCHEMBL1995038 0.86 FYN (0.42) JAK2JAK3FYNJAK1PIK3CA
SCHEMBL1996606 0.80 JAK2 (0.40) JAK2JAK3JAK1EIF2AK4CYP11B2
SCHEMBL1994074 0.75 EIF2AK4 (0.49) JAK2JAK3JAK1EIF2AK4FLT3
SCHEMBL2001202 0.74 MAPT (0.43) JAK2JAK3JAK1EIF2AK4FLT3
SCHEMBL1993988 0.70 EIF2AK4 (0.48) JAK2JAK3JAK1EIF2AK4FLT3
SCHEMBL1995489 0.69 JAK2 (0.38) JAK2JAK3JAK1EIF2AK4
SCHEMBL21194708 0.68 EIF2AK4 (0.48) JAK2JAK3JAK1EIF2AK4FLT3
SCHEMBL1996723 0.67 JAK2 (0.47) JAK2JAK3FYNEIF2AK4FLT3
SCHEMBL1995098 0.66 CYP11B1 (0.49) SQORCYP11B2PDGFRBCYP11B1
SCHEMBL30804680 0.65 ALDH1A1 (0.56) SQORCYP11B2

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-20130216498-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2013-08-22 US disclosed
US-20130216498-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2013-08-22 US disclosed
US-20130216498-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2013-08-22 US disclosed
EP-2516436-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS Almirall S.A. (ES) 2012-10-31 EP disclosed
WO-2011076419-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2011-06-30 WO disclosed
WO-2011076419-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2011-06-30 WO disclosed
EP-2338888-A1 Imidazopyridine derivatives as JAK inhibitors Almirall, S.A. (ES) 2011-06-29 EP disclosed
EP-2338888-A1 Imidazopyridine derivatives as JAK inhibitors Almirall, S.A. (ES) 2011-06-29 EP 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-20130216498-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS JAK1, JAK2, JAK3 JAK2 2/4885JAK3 3/4885FYN 411/4885

“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.