SCHEMBL8073111

SCHEMBL8073111

CCCCCCCCCCc1cnc(-c2ccc(OCC(C[C@@H](C)CCCC)O[C@@H]3CCCCO3)cc2)nc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.38
PLA2G2A P14555 9/20 0.36
PLA2G10 O15496 2/20 0.36
PLA2G1B P04054 2/20 0.36
PLA2G5 P39877 2/20 0.36
RAB9A P51151 5/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HSD17B10 Q99714 2/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 3/20 0.33
CASP3 P42574 1/20 0.32
SENP8 Q96LD8 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
SCHEMBL8072731 0.90 RARB (0.38) RARBPLA2G2APLA2G10PLA2G1BPLA2G5
SCHEMBL9345719 0.86 RARB (0.41) RARBPLA2G2APLA2G10PLA2G1BPLA2G5
SCHEMBL9345707 0.86 RARB (0.41) RARBPLA2G2APLA2G10PLA2G1BPLA2G5
SCHEMBL8077960 0.84 RARB (0.40) RARBPLA2G2APLA2G10PLA2G1BPLA2G5
SCHEMBL9424628 0.78 MEN1 (0.33) PLA2G2APLA2G10PLA2G1BPLA2G5RAB9A
SCHEMBL9424549 0.77 PLA2G2A (0.40) PLA2G2APLA2G10PLA2G1BPLA2G5RAB9A
SCHEMBL8064694 0.77 RARB (0.49) RARBPLA2G2APLA2G10PLA2G1BPLA2G5
SCHEMBL8075019 0.77 RARB (0.49) RARBPLA2G2APLA2G10PLA2G1BPLA2G5
SCHEMBL8078720 0.77 RARB (0.49) RARBPLA2G2APLA2G10PLA2G1BPLA2G5
SCHEMBL8064879 0.77 RARB (0.49) RARBPLA2G2APLA2G10PLA2G1BPLA2G5

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
US-6093345-A PYRIMIDINE COMPOUNDS, ELECTROOPTICS TAKASAGO INTERNATIONAL CORPORATION (JP) 2000-07-25 US disclosed