SCHEMBL17844396

SCHEMBL17844396

COc1cc(F)c(C#N)c(OC2CCN(C(=O)O)CC2)c1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR6 P46095 13/20 0.40
EGFR P00533 1/20 0.40
CPS1 P31327 2/20 0.38
ADRB2 P07550 1/20 0.38
MGLL Q99685 1/20 0.38
HSD11B1 P28845 1/20 0.37

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
SCHEMBL17837908 0.86 GPR119 (0.53)
SCHEMBL5776479 0.81 PDE4B (0.35) GPR6
SCHEMBL4689209 0.75 GPR6 (0.40) GPR6MGLL
SCHEMBL5774974 0.74 EGFR (0.44) EGFR
SCHEMBL1142588 0.73 GPR119 (0.53)
SCHEMBL26123273 0.73 DRD4 (0.40) MGLL
SCHEMBL26123279 0.73 DRD4 (0.40) MGLL
SCHEMBL26126288 0.73 DRD4 (0.40) MGLL
SCHEMBL15375545 0.73 PDE4B (0.48) GPR6
SCHEMBL31336127 0.72 EPHX2 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233829-A1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS Pfizer Inc (US) 2017-10-25 EP disclosed
WO-2016097918-A1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS PFIZER INC. (US) 2016-06-23 WO disclosed