SCHEMBL7010374

SCHEMBL7010374

COC(=O)c1cccc(CC(C)=O)c1[N+](=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.49
ALDH1A1 P00352 6/20 0.49
LMNA P02545 3/20 0.49
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
HPGD P15428 3/20 0.44
POLB P06746 3/20 0.44
KDM4E B2RXH2 2/20 0.42
PDGFRB P09619 1/20 0.42
FGFR1 P11362 1/20 0.42
PDGFRA P16234 1/20 0.42
FLT1 P17948 1/20 0.42
FGFR3 P22607 1/20 0.42
KDR P35968 1/20 0.42
MAPK8 P45983 1/20 0.40
MAPK9 P45984 1/20 0.40
MAPK10 P53779 1/20 0.40
MAPT P10636 3/20 0.40
MAPK1 P28482 3/20 0.40
TSHR P16473 1/20 0.39

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
SCHEMBL7419247 0.86 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1LMNAMEN1KMT2A
SCHEMBL16959264 0.85 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1LMNAMEN1KMT2A
SCHEMBL6658869 0.84 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1LMNAMEN1KMT2A
SCHEMBL30114672 0.84 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1LMNAMEN1KMT2A
SCHEMBL1031955 0.84 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1LMNAMEN1KMT2A
SCHEMBL4819062 0.84 HPGD (0.48) SMN1; SMN2ALDH1A1LMNAMEN1KMT2A
SCHEMBL1030553 0.84 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1LMNAMEN1KMT2A
SCHEMBL7415121 0.84 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1LMNAMEN1KMT2A
Ethylene SCHEMBL7415840 0.84 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1LMNAMEN1KMT2A
SCHEMBL8421994 0.83 ALDH1A1 (0.55) SMN1; SMN2ALDH1A1LMNAMEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1327631-A2 Fused heterocyclic compounds, their production and use as angiotensin II antagonists Takeda Chemical Industries, Ltd. (JP) 2003-07-16 EP disclosed
EP-0518033-B1 Fused heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-07-02 EP disclosed
US-5389641-A Fused heterocyclic compounds, having angiotensin II antagonistic activity TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-02-14 US disclosed
EP-0518033-A1 Fused heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-16 EP disclosed