SCHEMBL8697993

SCHEMBL8697993

C=C(OC1CCCCC1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP7 O15540 1/20 0.44
FABP5 Q01469 1/20 0.44
FAAH O00519 1/20 0.41
MGLL Q99685 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
BCHE P06276 1/20 0.41
RAB9A P51151 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 2/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MMP9 P14780 2/20 0.38
MMP12 P39900 2/20 0.38
MMP1 P03956 1/20 0.38
POLB P06746 1/20 0.38
ELANE P08246 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
SCN1A P35498 1/20 0.38

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
SCHEMBL1994114 0.79 FABP7 (0.47) FABP7FABP5FAAHMGLLSMN1; SMN2
SCHEMBL31139240 0.77 MEN1 (0.63) FABP7FABP5SMN1; SMN2RAB9AMEN1
SCHEMBL11592049 0.77 MEN1 (0.63) FABP7FABP5SMN1; SMN2RAB9AMEN1
SCHEMBL2703498 0.77 FABP7 (0.44) FABP7FABP5FAAHMGLLSMN1; SMN2
SCHEMBL60478 0.77 MEN1 (0.63) FABP7FABP5SMN1; SMN2RAB9AMEN1
SCHEMBL14720174 0.77 MEN1 (0.63) FABP7FABP5SMN1; SMN2RAB9AMEN1
SCHEMBL6057178 0.77 FABP7 (0.44) FABP7FABP5FAAHMGLLSMN1; SMN2
Ammonia Solution, Strong SCHEMBL597060 0.76 MEN1 (0.61) FABP7FABP5SMN1; SMN2RAB9AMEN1
SCHEMBL15967850 0.75 LMNA (0.44) SMN1; SMN2RAB9AMEN1KMT2ANPC1
SCHEMBL1926317 0.74 MEN1 (0.65) SMN1; SMN2RAB9AMEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998049128-A1 PROCESS FOR PREPARING A (HETERO)AROMATIC OLEFIN DSM N.V. (NL) 1998-11-05 WO disclosed