SCHEMBL5500672

SCHEMBL5500672

O=C1CCCN1C1CCOCC1Cc1ccc(Cl)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP2A13 Q16696 1/20 0.39
P2RX7 Q99572 12/20 0.39
KMT2A Q03164 1/20 0.38
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
SIGMAR1 Q99720 1/20 0.36
EPHX2 P34913 2/20 0.36

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
SCHEMBL5501290 0.80 KMT2A (0.43) P2RX7KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL5500515 0.80 P2RX7 (0.42) P2RX7KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL4061678 0.79 F10 (0.30)
SCHEMBL5503442 0.75 P2RX7 (0.41) P2RX7KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL5500031 0.74 P2RX7 (0.44) P2RX7KMT2AEPHX2
SCHEMBL5505679 0.73 P2RX7 (0.44) P2RX7KMT2AEPHX2
SCHEMBL5505968 0.72 P2RX7 (0.41) P2RX7KMT2A
SCHEMBL5505535 0.72 P2RX7 (0.41) P2RX7KMT2ASIGMAR1
SCHEMBL5499762 0.72 P2RX7 (0.42) P2RX7KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL5505772 0.70 KMT2A (0.35) P2RX7KMT2ALMNASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1807072-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-07-18 EP claimed
WO-2006049952-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2006-05-11 WO claimed