SCHEMBL7753968

SCHEMBL7753968

CCCOC=CCCCO

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
MGLL Q99685 1/20 0.34
CNR2 P34972 3/20 0.33
LMNA P02545 2/20 0.33
TSHR P16473 2/20 0.33
TRPV1 Q8NER1 2/20 0.33
CNR1 P21554 2/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LPAR3 Q9UBY5 1/20 0.32

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
SCHEMBL7754325 0.89 TSHR (0.41) ALDH1A1SMN1; SMN2MGLLCNR2LMNA
SCHEMBL7755350 0.88 SMN1; SMN2 (0.42) ALDH1A1SMN1; SMN2CNR2LMNATSHR
SCHEMBL7754403 0.86
SCHEMBL7756612 0.86 LMNA (0.44) ALDH1A1SMN1; SMN2CNR2LMNATSHR
SCHEMBL386670 0.84 LPAR3 (0.38) ALDH1A1TSHRTRPV1LPAR3
SCHEMBL1195860 0.83 TSHR (0.43) ALDH1A1MGLLCNR2TSHRTRPV1
SCHEMBL4936842 0.82
SCHEMBL4936087 0.82
SCHEMBL4936077 0.82
SCHEMBL7770458 0.82 LMNA (0.44) ALDH1A1SMN1; SMN2MGLLCNR2LMNA

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-0835248-B1 1-AMINO-3-BENZYLURACILS BASF AG (DE) 2001-02-21 EP disclosed
EP-0835248-A1 1-AMINO-3-BENZYLURACILS BASF AKTIENGESELLSCHAFT (DE) 1998-04-15 EP disclosed
WO-1997001543-A1 1-AMINO-3-BENZYLURACILS BASF AKTIENGESELLSCHAFT (DE) 1997-01-16 WO disclosed