SCHEMBL2031795

SCHEMBL2031795

Oc1nc(-c2cnc3ccc(F)cn23)ncc1C1CC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 11/20 0.50
JAK3 P52333 11/20 0.50
JAK1 P23458 10/20 0.50
CYP11B1 P15538 4/20 0.39
CYP11B2 P19099 4/20 0.39
CYP19A1 P11511 1/20 0.39
EIF2AK4 Q9P2K8 4/20 0.38
ADORA2A P29274 1/20 0.38

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
SCHEMBL1995249 0.83 JAK2 (0.47) JAK2JAK3JAK1EIF2AK4ADORA2A
SCHEMBL1991742 0.81 JAK2 (0.45) JAK2JAK3JAK1ADORA2A
SCHEMBL1994455 0.81 JAK2 (0.46) JAK2JAK3JAK1CYP11B1CYP11B2
SCHEMBL2035510 0.80 JAK2 (0.43) JAK2JAK3JAK1ADORA2A
SCHEMBL16824624 0.78 JAK2 (0.43) JAK2JAK3JAK1CYP11B1CYP11B2
SCHEMBL2034673 0.78 JAK2 (0.43) JAK2JAK3JAK1ADORA2A
SCHEMBL2033388 0.78 JAK2 (0.44) JAK2JAK3JAK1
SCHEMBL12643874 0.78 JAK2 (0.43) JAK2JAK3JAK1EIF2AK4ADORA2A
SCHEMBL15198117 0.76 JAK2 (0.45) JAK2JAK3JAK1EIF2AK4ADORA2A
SCHEMBL12643665 0.76 JAK2 (0.42) JAK2JAK3JAK1ADORA2A

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 6 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

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 3/4885JAK1 1/4885

“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.