SCHEMBL22736187

SCHEMBL22736187

CC(C)OC(c1ccc(-n2cc(-c3ccnc4[nH]cnc34)cn2)nc1)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 3/20 0.34
▸ JAK2 O60674 1/20 0.31
▸ EGLN1 Q9GZT9 1/20 0.31
▸ AURKA O14965 1/20 0.31
▸ AURKB Q96GD4 1/20 0.31
▸ INCENP Q9NQS7 1/20 0.31
▸ TPX2 Q9ULW0 1/20 0.31
▸ MAPK1 P28482 1/20 0.31

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
SCHEMBL29568178 1.00 GRM4 (0.34) GRM4JAK2EGLN1AURKAAURKB
SCHEMBL22736011 0.91 GRM4 (0.35) GRM4JAK2EGLN1AURKAAURKB
SCHEMBL29480656 0.91 GRM4 (0.35) GRM4JAK2EGLN1AURKAAURKB
SCHEMBL29480579 0.86 GRM4 (0.34) GRM4JAK2EGLN1AURKAAURKB
SCHEMBL22716906 0.86 GRM4 (0.32) GRM4JAK2
SCHEMBL29567531 0.86 GRM4 (0.32) GRM4JAK2
SCHEMBL29480550 0.85 GCG (0.33) GRM4
SCHEMBL22736472 0.85 JAK2 (0.32) GRM4JAK2
SCHEMBL29567309 0.85 JAK2 (0.32) GRM4JAK2
SCHEMBL22736243 0.84 JAK2 (0.34) GRM4JAK2

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
WO-2020240586-A1 NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 MANKIND PHARMA LTD. (IN) 2020-12-03 — — WO disclosed
Send feedback