SCHEMBL8770574

SCHEMBL8770574

CC(C)OC(=O)COc1ccc(N)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.67
TSHR P16473 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
TP53 P04637 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
POLB P06746 1/20 0.44
RXFP1 Q9HBX9 1/20 0.43
PSEN1 P49768 1/20 0.43
PSEN2 P49810 1/20 0.43
APH1B Q8WW43 1/20 0.43
NCSTN Q92542 1/20 0.43
APH1A Q96BI3 1/20 0.43
PSENEN Q9NZ42 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 2/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 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
SCHEMBL13823115 0.86 MAPT (0.67) MAPTTDP1TP53SMN1; SMN2RAB9A
SCHEMBL23605758 0.84 MAPT (0.69) MAPTTP53SMN1; SMN2RAB9ANPC1
SCHEMBL23605662 0.83 MAPT (0.67) MAPTTSHRTDP1SMN1; SMN2RAB9A
SCHEMBL23605977 0.83 MAPT (0.67) MAPTSMN1; SMN2POLBALDH1A1GAA
SCHEMBL24806561 0.83 MAPT (0.67) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL272026 0.82 MAPT (0.81) MAPTTSHRSMN1; SMN2RAB9ANPC1
SCHEMBL20685285 0.82 MAPT (0.57) MAPTTSHRTDP1TP53NPC1
SCHEMBL11658855 0.81 MAPT (0.65) MAPTRAB9APOLBL3MBTL1ALDH1A1
SCHEMBL345002 0.81 MAPT (0.56) MAPTTSHRTDP1TP53RXFP1
SCHEMBL2009719 0.81 MAPT (0.60) MAPTSMN1; SMN2RAB9ANPC1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0632019-B1 Acylureas ZENECA LTD (GB) 1997-09-24 EP disclosed
US-5576334-A ANTICOAGULANTS ZENECA LIMITED (GB) 1996-11-19 US disclosed
EP-0632019-A1 Acylureas ZENECA LIMITED (GB) 1995-01-04 EP disclosed