SCHEMBL5504170

SCHEMBL5504170

O=C1CCCN1C1CCCC(Cc2ccc(Cl)c(-c3cccnc3)c2Cl)C1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.36
PDCD1LG2 Q9BQ51 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
KDM4E B2RXH2 1/20 0.33
GBA1 P04062 2/20 0.33
CYP11B2 P19099 2/20 0.33
PIM1 P11309 2/20 0.33
CYP11B1 P15538 1/20 0.33
CCR5 P51681 1/20 0.32
TGM2 P21980 1/20 0.31
HTR5A P47898 2/20 0.31
SPR P35270 1/20 0.31
MAPT P10636 1/20 0.31
HTR6 P50406 1/20 0.31

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
Hydrochloric Acid SCHEMBL5499839 0.99 CNR1 (0.36) CNR1PDCD1LG2CD274KDM4EGBA1
SCHEMBL5503412 0.89 PDCD1LG2 (0.33) PDCD1LG2CD274
Hydrochloric Acid SCHEMBL5504025 0.88 PDCD1LG2 (0.33) PDCD1LG2CD274
SCHEMBL5499996 0.86 CNR1 (0.38) CNR1KDM4ECYP11B2CYP11B1CCR5
Hydrochloric Acid SCHEMBL5504549 0.85 CNR1 (0.38) CNR1KDM4ECYP11B2CYP11B1CCR5
SCHEMBL5500821 0.84 CNR1 (0.38) CNR1CYP11B2PIM1CYP11B1CCR5
SCHEMBL5504883 0.84 CYP11B2 (0.35) CNR1PDCD1LG2CD274KDM4EGBA1
Hydrochloric Acid SCHEMBL5503796 0.83 CYP11B2 (0.34) CNR1PDCD1LG2CD274KDM4EGBA1
SCHEMBL5504107 0.82 CYP11B2 (0.41) CNR1KDM4ECYP11B2PIM1CYP11B1
Hydrochloric Acid SCHEMBL5504176 0.81 CYP11B2 (0.40) CNR1KDM4ECYP11B2PIM1CYP11B1

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