SCHEMBL856566

SCHEMBL856566

COC(=O)[C@H]1C(C(=O)Nc2ccc(C)cn2)[C@@H]2C=C[C@H]1C21CC1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 13/20 0.67
FPR3 P25089 6/20 0.60
MAPT P10636 2/20 0.47
RAB9A P51151 1/20 0.47
PKM P14618 1/20 0.44
POLB P06746 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL2682790 1.00 FPR2 (0.67) FPR2FPR3MAPTRAB9APKM
SCHEMBL2681701 0.88 FPR2 (0.69) FPR2FPR3MAPTRAB9APKM
SCHEMBL12040468 0.88 FPR2 (0.69) FPR2FPR3MAPTRAB9APKM
SCHEMBL856539 0.88 FPR2 (0.69) FPR2FPR3MAPTRAB9APKM
SCHEMBL856665 0.87 FPR2 (0.59) FPR2FPR3
SCHEMBL2683985 0.87 FPR2 (0.59) FPR2FPR3
SCHEMBL2684181 0.80 FPR2 (1.00) FPR2FPR3
SCHEMBL855038 0.77 FPR2 (0.66) FPR2FPR3
SCHEMBL2682592 0.77 FPR2 (0.66) FPR2FPR3
SCHEMBL2683448 0.77 FPR2 (0.60) FPR2FPR3ALDH1A1SMN1; SMN2

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
EP-2432760-A1 BRIDGED SPIRO [2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS Actelion Pharmaceuticals Ltd. (CH) 2012-03-28 EP disclosed