SCHEMBL3150873

SCHEMBL3150873

CN(C(=O)O)C1(COc2cnc(F)c(-c3ccncc3)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
CYP46A1 Q9Y6A2 2/20 0.34
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
ORAI1 Q96D31 1/20 0.34
FFAR4 Q5NUL3 3/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
AXL P30530 1/20 0.33

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
SCHEMBL3151386 0.90 CYP11B1 (0.36) CYP11B1CYP11B2CYP46A1CYP4F2CYP4A11
SCHEMBL3151304 0.90 CYP11B1 (0.39) CYP11B1CYP11B2AKR1C3AKR1C2
SCHEMBL3137211 0.88 FFAR4 (0.38) FFAR4
SCHEMBL3155887 0.88 FFAR4 (0.36) FFAR4
SCHEMBL3147054 0.87 FFAR4 (0.38) CYP11B1CYP11B2FFAR4
SCHEMBL3138316 0.87 KDM1A (0.41)
SCHEMBL3779567 0.85 FFAR4 (0.32) CYP11B1CYP11B2CYP4F2CYP4A11FFAR4
SCHEMBL3151485 0.84 SLC6A9 (0.37)
SCHEMBL3151351 0.82 PTGDR2 (0.38)
SCHEMBL3145775 0.80 CYP11B1 (0.40) CYP11B1CYP11B2

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-1979321-B9 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2010-02-17 EP disclosed
EP-1979321-B1 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2009-07-29 EP disclosed