SCHEMBL8558794

SCHEMBL8558794

COc1ccc(CSc2nc(C)c(NC=O)c(-c3ccc([N+](=O)[O-])cc3)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.48
▸ POLB P06746 1/20 0.48
▸ SMN1; SMN2 Q16637 6/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ LMNA P02545 3/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ HTT P42858 2/20 0.47
▸ NCOA1 Q15788 1/20 0.47
▸ NCOA3 Q9Y6Q9 1/20 0.47
▸ HPGD P15428 2/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ CRHBP P24387 1/20 0.45
▸ CRHR2 Q13324 1/20 0.45
▸ GAA P10253 2/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ RECQL P46063 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ DCUN1D1 Q96GG9 1/20 0.41
▸ SLC29A1 Q99808 1/20 0.41

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
SCHEMBL6221292 0.83 POLB (0.54) MAPTPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL98711 0.74 SLC29A1 (0.53) MAPTPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL10724090 0.71 MAPT (0.49) MAPTPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL10913886 0.70 KDM4E (0.50) MAPTPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL28070731 0.69 APP (0.60) MAPTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL5654152 0.67 MAPT (1.00) MAPTPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL2455303 0.65 APP (0.74) MAPTPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL3974325 0.65 APP (0.74) MAPTPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL9831511 0.64 ALDH1A1 (0.52) MAPTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL15986005 0.64 LMNA (0.47) MAPTPOLBSMN1; SMN2KMT2AMEN1

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-0790826-A4 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMA CORP (US) 1998-11-11 — — EP disclosed
EP-0790826-A1 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1997-08-27 — — EP disclosed
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