SCHEMBL4037786

SCHEMBL4037786

NC(=O)NC=O.O=C(c1cccc(Cl)c1)N1CCN(c2ccc(Cl)c(Cl)c2)C[C@H]1[C@@H]1CCc2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 18/20 0.47

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
SCHEMBL4032546 1.00 HSD11B1 (0.47) HSD11B1
SCHEMBL4033360 1.00 HSD11B1 (0.47) HSD11B1
SCHEMBL4035814 1.00 HSD11B1 (0.47) HSD11B1
SCHEMBL4036731 1.00 HSD11B1 (0.47) HSD11B1
SCHEMBL4038511 0.89 HSD11B1 (0.43) HSD11B1
SCHEMBL4037368 0.75 CCR1 (0.39)
SCHEMBL16276190 0.65 SMN1; SMN2 (0.68)
SCHEMBL1950324 0.65 HSD11B1 (1.00) HSD11B1
SCHEMBL1950325 0.65 HSD11B1 (1.00) HSD11B1
SCHEMBL15139477 0.65 HSD11B1 (1.00) HSD11B1

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
EP-1592389-B1 PIPERAZINE-2-CARBOXAMIDE DERIVATIVES SERONO LAB (CH) 2009-04-22 EP claimed