SCHEMBL27756117

SCHEMBL27756117

CC1(C)Oc2cc([N+](=O)[O-])cc(Cl)c2N(c2ccc(F)cc2)C1C=O

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HSD11B1 P28845 1/20 0.33
▸ PMM2 O15305 1/20 0.32
▸ MPI P34949 1/20 0.32
▸ PHOSPHO1 Q8TCT1 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ KMT2A Q03164 1/20 0.30
▸ HSD17B10 Q99714 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
SCHEMBL27735501 0.88 POLB (0.34) POLBLMNAHSD11B1PMM2MPI
SCHEMBL27735492 0.88 POLB (0.34) POLBLMNAMAPTHSD11B1PMM2
SCHEMBL27756134 0.86 POLB (0.33) POLBHSD11B1PMM2MPIPHOSPHO1
SCHEMBL27735513 0.86 PTGS1 (0.35) POLBLMNAMAPTHSD11B1PMM2
SCHEMBL27756111 0.85 POLB (0.34) POLBLMNAHSD11B1PMM2MPI
SCHEMBL27735516 0.85 PMM2 (0.32) POLBMAPTHSD11B1PMM2MPI
SCHEMBL27735498 0.84 HSD11B1 (0.34) HSD11B1
SCHEMBL27756110 0.80 ALDH1A1 (0.33) POLBLMNAMAPTHSD11B1PMM2
SCHEMBL27735521 0.77 WDR5 (0.39) POLBLMNAMAPTALDH1A1KMT2A
SCHEMBL757925 0.74 NR3C2 (0.45) MAPK14POLBLMNAMAPTPMM2

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
CN-101379048-A Benzo  oxazines and related nitrogen-containing heterobicyclic compounds useful as mineralocorticoid receptor modulating agents MITSUBISHI TANABE PHARMA CORP (JP) 2009-03-04 — — CN disclosed
Send feedback