SCHEMBL2270892

SCHEMBL2270892

FC(F)(F)c1cc(-c2cccn3nc(Br)nc23)cc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 17/20 0.56
JAK3 P52333 11/20 0.47
PTK2 Q05397 10/20 0.43
AHR P35869 1/20 0.36
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 0.34

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
SCHEMBL18615000 0.92 JAK2 (0.51) JAK2JAK3PTK2AHR
SCHEMBL18615002 0.91 JAK2 (0.57) JAK2JAK3PTK2
SCHEMBL18615228 0.89 JAK2 (0.71) JAK2JAK3PTK2AHR
SCHEMBL2273181 0.83 JAK2 (0.80) JAK2JAK3PTK2
SCHEMBL18615100 0.81 JAK2 (0.48) JAK2JAK3PTK2
SCHEMBL18615124 0.81 JAK2 (0.56) JAK2JAK3PTK2AHR
SCHEMBL18615021 0.80 JAK2 (0.47) JAK2JAK3PTK2AHR
SCHEMBL18615251 0.79 JAK2 (0.42) JAK2JAK3PTK2AHR
SCHEMBL15796893 0.79 JAK2 (0.50) JAK2JAK3PTK2AHR
SCHEMBL2271283 0.78 JAK2 (0.44) JAK2JAK3PTK2AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2536710-B1 PIPERIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2016-07-13 EP disclosed
US-8486967-B2 Heteroaryl substituted piperidines HOFFMANN-LA ROCHE INC. (US) 2013-07-16 US disclosed
EP-2536710-A2 PIPERIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2012-12-26 EP disclosed
WO-2011101304-A2 PIPERIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-08-25 WO disclosed
US-20110201605-A1 HETEROARYL SUBSTITUTED PIPERIDINES HOFFMANN-LA ROCHE, INC. 2011-08-18 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-20110201605-A1 HETEROARYL SUBSTITUTED PIPERIDINES APP, HPGDS, PSEN1 JAK2 3153/4885JAK3 4312/4885PTK2 1849/4885

“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.