SCHEMBL11558077

SCHEMBL11558077

CC1(C)Oc2ccc(N)cc2NC1CN1C(=O)CCC1=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ATAD2 Q6PL18 1/20 0.38
▸ CA9 Q16790 1/20 0.33
▸ AKT1 P31749 1/20 0.33
▸ OPRM1 P35372 1/20 0.31
▸ OPRD1 P41143 1/20 0.31
▸ OPRK1 P41145 1/20 0.31
▸ PDE3B Q13370 1/20 0.30
▸ PDE3A Q14432 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL11557429 0.87 MMP12 (0.38) PDE3BPDE3AKDM4EALDH1A1
SCHEMBL11560192 0.86 LMNA (0.38) SMN1; SMN2
SCHEMBL11558220 0.86 KCNE1 (0.34) —
SCHEMBL11558080 0.86 MAPT (0.36) AKT1PDE3BPDE3AKDM4EALDH1A1
SCHEMBL11559728 0.84 GAA (0.37) KDM4EALDH1A1SMN1; SMN2
SCHEMBL11559426 0.83 TRPV1 (0.35) —
SCHEMBL11560034 0.83 SMN1; SMN2 (0.37) CA9KDM4EALDH1A1SMN1; SMN2
SCHEMBL11565708 0.83 PTGS2 (0.34) CA9
SCHEMBL11560946 0.83 ALPL (0.34) KDM4EALDH1A1SMN1; SMN2
SCHEMBL11556858 0.80 BRD4 (0.38) —

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
US-4134974-A Imidazo[5,1-c][1,4]benzoxazin-1-one CARLO ERBA S. P. A. (IT) 1979-01-16 — — US disclosed
Send feedback