SCHEMBL3387663

SCHEMBL3387663

C[C@H](c1ccccc1)C1CC1(C(N)=O)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.42
EPHX1 P07099 1/20 0.41
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
EPHX2 P34913 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
KMT2A Q03164 2/20 0.38
RECQL P46063 1/20 0.37
FAAH O00519 1/20 0.37
POLB P06746 1/20 0.37
PTGS2 P35354 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
SCHEMBL4558688 0.81 SLC6A2 (0.45) ALOX5
SCHEMBL17320338 0.76 CYP3A4 (0.43) LMNAHPGDEPHX2KMT2APOLB
SCHEMBL4560519 0.75 OPRL1 (0.41) ALOX5
SCHEMBL4862036 0.74 KMT2A (0.39) EPHX1LMNAHPGDKMT2ARECQL
SCHEMBL17499960 0.74 CYP2D6 (0.39) LMNAHPGDKMT2APOLB
SCHEMBL17311743 0.74 CYP2D6 (0.39) LMNAHPGDKMT2APOLB
SCHEMBL17311744 0.74 CYP2D6 (0.39) LMNAHPGDKMT2APOLB
SCHEMBL4558510 0.72 OPRL1 (0.39) EPHX1LMNAHPGDKMT2A
SCHEMBL4973221 0.72 RECQL (0.38) ALOX5EPHX1LMNAHPGDEPHX2
SCHEMBL17311691 0.70 CYP3A4 (0.39) LMNAEPHX2KMT2A

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-2010051373-A1 CYCLOPROPANE AMIDES AND ANALOGS EXHIBITING ANTI-CANCER AND ANTI-PROLIFERATIVE ACTIVITIES DECIPHERA PHARMACEUTICALS, LLC (US) 2010-05-06 WO disclosed