SCHEMBL4182870

SCHEMBL4182870

O=C1NCCC1C(c1c(Cl)cc(-c2ccc(F)cc2)cc1Cl)C1CCC(Br)CC1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.32
APOL1 O14791 1/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 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
SCHEMBL209419 0.73 POLB (0.37)
SCHEMBL4067647 0.73 POLB (0.37)
SCHEMBL2998442 0.73 PGR (0.37)
SCHEMBL208452 0.73 PDE4D (0.35)
SCHEMBL208914 0.73 PGR (0.37)
SCHEMBL208949 0.72 RHEB (0.36)
SCHEMBL208546 0.72 PARP10 (0.37)
SCHEMBL208481 0.72 SLC6A3 (0.41)
SCHEMBL474994 0.71 KDM4E (0.35)
SCHEMBL208541 0.70 SRD5A2 (0.32)

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-2021337-A2 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2009-02-11 EP disclosed
WO-2007127726-A2 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-08 WO disclosed