SCHEMBL7657400

SCHEMBL7657400

N#Cc1cc(-c2nnn[nH]2)ccc1Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
MAPT P10636 6/20 0.50
ALDH1A1 P00352 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
MEN1 O00255 6/20 0.49
KMT2A Q03164 6/20 0.49
PYGL P06737 4/20 0.47
CRHBP P24387 2/20 0.47
CRHR2 Q13324 2/20 0.47
FFAR1 O14842 1/20 0.46
SETD7 Q8WTS6 1/20 0.46
KDM4E B2RXH2 1/20 0.45
HTT P42858 1/20 0.45
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
MMP13 P45452 1/20 0.45
THRA P10827 1/20 0.45

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
SCHEMBL7192138 0.81 MAPT (0.58) LMNASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL7118162 0.80 MAPT (0.58) LMNASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL12338884 0.75 MEN1 (0.83) LMNASMN1; SMN2MAPTALDH1A1NPC1
SCHEMBL9589707 0.73 NPC1 (0.49) SMN1; SMN2ALDH1A1NPC1RAB9AMEN1
SCHEMBL7126561 0.72 MAPT (0.72) LMNASMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL27676573 0.72 FFAR1 (0.80) LMNASMN1; SMN2MAPTALDH1A1NPC1
SCHEMBL31315570 0.72 FFAR1 (0.80) LMNASMN1; SMN2MAPTALDH1A1NPC1
SCHEMBL5149578 0.71 MEN1 (0.55) LMNASMN1; SMN2MAPTALDH1A1NPC1
SCHEMBL8533619 0.70 KMT2A (0.60) LMNASMN1; SMN2MAPTALDH1A1NPC1
SCHEMBL14567941 0.69 MAPT (0.74) LMNASMN1; SMN2MAPTALDH1A1NPC1

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
EP-1220832-A1 NOVEL AROMATIC COMPOUNDS NOVO NORDISK A/S (DK) 2002-07-10 EP disclosed
WO-2001023347-A1 NOVEL AROMATIC COMPOUNDS NOVO NORDISK A/S (DK) 2001-04-05 WO disclosed