SCHEMBL7312574

SCHEMBL7312574

CC(=O)c1c([N+](=O)[O-])ccc(OC(C(N)=O)N2CCCC3CCCCC32)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 2/20 0.31
NPC1 O15118 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 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
SCHEMBL7316434 0.87 MAPT (0.35) MAPTL3MBTL1KDM4ENPC1SMN1; SMN2
SCHEMBL7307522 0.85 MAPT (0.35) MAPTL3MBTL1KDM4ENPC1SMN1; SMN2
SCHEMBL10374597 0.74 ERN1 (0.33) MAPTL3MBTL1KDM4ENPC1SMN1; SMN2
SCHEMBL7312566 0.73 SMN1; SMN2 (0.43) L3MBTL1KDM4ENPC1SMN1; SMN2ALDH1A1
SCHEMBL10376145 0.72 POLB (0.31) L3MBTL1KDM4ESMN1; SMN2ALDH1A1RAB9A
SCHEMBL7316139 0.68 ALDH1A1 (0.31) L3MBTL1KDM4EALDH1A1
SCHEMBL31145936 0.67 TDP1 (0.46) MAPTL3MBTL1KDM4EALDH1A1KMT2A
SCHEMBL7304380 0.66 PDE3B (0.36)
SCHEMBL7309546 0.65 PDE3B (0.40)
SCHEMBL7309670 0.63 KDM4E (0.35) MAPTL3MBTL1KDM4EALDH1A1KMT2A

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-4670434-A ANTICOAGULANT, INOTROPIC AGENT SYNTEX (U.S.A.) INC. (US) 1987-06-02 US disclosed