SCHEMBL8345876

SCHEMBL8345876

CCOC(=O)CN(C)c1ccc(Cn2cccc(-c3ccc([N+](=O)[O-])cc3)c2=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 3/20 0.42
AR P10275 2/20 0.41
LMNA P02545 2/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
ITGB1 P05556 3/20 0.40
ITGA4 P13612 3/20 0.40
GNRHR P30968 1/20 0.39
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
PRKCZ Q05513 1/20 0.38
APP P05067 1/20 0.37

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
SCHEMBL14096923 0.87 FNTA (0.42) RAB9ASMN1; SMN2ALDH1A1MAPTAR
SCHEMBL8345236 0.87 ITGB1 (0.42) ALDH1A1ITGB1ITGA4GNRHR
SCHEMBL5069308 0.86 ITGB1 (0.48) RAB9ASMN1; SMN2ALDH1A1MAPTAR
SCHEMBL8345075 0.83 ITGB1 (0.45) RAB9ASMN1; SMN2ALDH1A1MAPTAR
SCHEMBL5068327 0.78 ITGB1 (0.69) MAPTITGB1ITGA4MEN1KMT2A
SCHEMBL8344869 0.75 MAPT (0.39) RAB9ASMN1; SMN2ALDH1A1MAPTLMNA
SCHEMBL14096909 0.73 ITGB1 (0.48) ALDH1A1MAPTITGB1ITGA4
SCHEMBL27614659 0.73 ITGB1 (0.50) ITGB1ITGA4
SCHEMBL5068957 0.72 CYP4F2 (0.44) RAB9ASMN1; SMN2ALDH1A1MAPTAR
SCHEMBL5068369 0.72 RAB9A (0.45) RAB9ASMN1; SMN2ALDH1A1MAPTAR

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
US-7410984-B2 Compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-08-12 US disclosed
WO-2004014859-A2 PROCESS FOR PREPARING QUINOLIN ANTIBIOTIC INTERMEDIATES TANABE SEIYAKU CO., LTD. (JP) 2004-02-19 WO disclosed