SCHEMBL7755350

SCHEMBL7755350

CCCCCOC=CCCCO

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 2/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
LMNA P02545 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HSD17B10 Q99714 1/20 0.41
TSHR P16473 1/20 0.41
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
MAPT P10636 1/20 0.41
LPAR1 Q92633 1/20 0.41
LPAR2 Q9HBW0 1/20 0.41
LPAR3 Q9UBY5 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
SCHEMBL7756612 0.98 LMNA (0.44) SMN1; SMN2ALDH1A1CNR1CNR2LMNA
SCHEMBL7754325 0.94 TSHR (0.41) SMN1; SMN2ALDH1A1CNR1CNR2LMNA
SCHEMBL7770458 0.90 LMNA (0.44) SMN1; SMN2ALDH1A1CNR1CNR2LMNA
SCHEMBL7755108 0.90 MEN1 (0.42) SMN1; SMN2ALDH1A1CNR1CNR2LMNA
SCHEMBL7756678 0.88 MEN1 (0.45) SMN1; SMN2ALDH1A1CNR1CNR2LMNA
SCHEMBL7753968 0.88 ALDH1A1 (0.36) SMN1; SMN2ALDH1A1CNR1CNR2LMNA
SCHEMBL23501872 0.87 LPAR3 (0.41) ALDH1A1CNR1CNR2LPAR1LPAR2
SCHEMBL23501869 0.87 LPAR3 (0.41) ALDH1A1CNR1CNR2LPAR1LPAR2
SCHEMBL9491967 0.86 MGLL (0.47) ALDH1A1CNR1CNR2MEN1KMT2A
SCHEMBL25228930 0.85 LPAR2 (0.48) LPAR1LPAR2LPAR3

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