SCHEMBL5500515

SCHEMBL5500515

CC1C(Cc2ccc(Cl)cc2Cl)CCCC1N1CCCC1=O

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 17/20 0.42
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SIGMAR1 Q99720 1/20 0.38

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
SCHEMBL5505772 0.89 KMT2A (0.35) P2RX7KMT2ALMNASMN1; SMN2
SCHEMBL5501290 0.86 KMT2A (0.43) P2RX7KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL5503442 0.85 P2RX7 (0.41) P2RX7KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL5500083 0.84 HCRTR1 (0.33) P2RX7
Hydrochloric Acid SCHEMBL5505760 0.84 HCRTR1 (0.33)
SCHEMBL5505535 0.83 P2RX7 (0.41) P2RX7KMT2ASIGMAR1
SCHEMBL5509665 0.81 CYP11B1 (0.38)
SCHEMBL5500672 0.80 CYP2A13 (0.39) P2RX7KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL5500662 0.78 F10 (0.33) KMT2A
SCHEMBL5500660 0.78 F10 (0.33) KMT2A

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 disclosed
WO-2006049952-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2006-05-11 WO disclosed