SCHEMBL29480579

SCHEMBL29480579

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

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 3/20 0.34
▸ EGLN1 Q9GZT9 1/20 0.33
▸ JAK2 O60674 1/20 0.33
▸ AURKA O14965 1/20 0.31
▸ AURKB Q96GD4 1/20 0.31
▸ INCENP Q9NQS7 1/20 0.31
▸ TPX2 Q9ULW0 1/20 0.31
▸ OGA O60502 1/20 0.31
▸ GCG P01275 1/20 0.30

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
SCHEMBL22736484 0.89 GRM4 (0.35) GRM4EGLN1JAK2AURKAAURKB
SCHEMBL29480552 0.89 GRM4 (0.35) GRM4EGLN1JAK2AURKAAURKB
SCHEMBL29568178 0.86 GRM4 (0.34) GRM4EGLN1JAK2AURKAAURKB
SCHEMBL22736187 0.86 GRM4 (0.34) GRM4EGLN1JAK2AURKAAURKB
SCHEMBL22736011 0.86 GRM4 (0.35) GRM4EGLN1JAK2AURKAAURKB
SCHEMBL29480656 0.86 GRM4 (0.35) GRM4EGLN1JAK2AURKAAURKB
SCHEMBL22735737 0.85 GRM4 (0.35) GRM4JAK2AURKAAURKBINCENP
SCHEMBL29567952 0.85 GRM4 (0.35) GRM4JAK2AURKAAURKBINCENP
SCHEMBL22735745 0.84 GRM4 (0.34) GRM4EGLN1JAK2AURKAAURKB
SCHEMBL22735739 0.84 GRM4 (0.34) GRM4EGLN1JAK2AURKAAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114174294-B Novel compounds for inhibiting JANUS kinase 1 人类制药有限公司 2024-10-25 — — CN claimed
CN-114174294-A Novel compounds for inhibiting JANUS kinase 1 人类制药有限公司 2022-03-11 — — CN claimed
CN-114174294-B Novel compounds for inhibiting JANUS kinase 1 人类制药有限公司 2024-10-25 — — CN disclosed
CN-114174294-A Novel compounds for inhibiting JANUS kinase 1 人类制药有限公司 2022-03-11 — — CN disclosed
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