SCHEMBL16248947

SCHEMBL16248947

Cc1nc2cccc(-c3cccc(C(C)C)c3)n2n1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 12/20 0.63
▸ EGLN2 Q96KS0 4/20 0.57
▸ NUDT1 P36639 2/20 0.43
▸ RXRA P19793 1/20 0.39
▸ RXRB P28702 1/20 0.39
▸ RXRG P48443 1/20 0.39
▸ JAK1 P23458 2/20 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
SCHEMBL1422839 0.84 NUDT1 (0.64) JAK2EGLN2NUDT1JAK1
SCHEMBL13465775 0.81 JAK2 (0.79) JAK2EGLN2JAK1
SCHEMBL19659204 0.80 EGLN2 (0.68) JAK2EGLN2NUDT1JAK1
SCHEMBL3211261 0.78 JAK2 (0.73) JAK2
SCHEMBL3216684 0.78 JAK2 (0.81) JAK2
SCHEMBL16248946 0.78 JAK2 (0.79) JAK2EGLN2JAK1
SCHEMBL13276213 0.78 JAK2 (1.00) JAK2
SCHEMBL3218020 0.78 JAK2 (1.00) JAK2
SCHEMBL3214501 0.76 JAK2 (1.00) JAK2EGLN2JAK1
SCHEMBL3203884 0.76 JAK2 (1.00) JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8889673-B2 Triazolopyridine JAK inhibitor compounds and methods GENENTECH, INC. (US) 2014-11-18 — — US disclosed
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