SCHEMBL8073331

SCHEMBL8073331

CCCCCCCCCCc1cnc(-c2ccc(OCC(F)C(C)CC)cc2)nc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.51
RAB9A P51151 7/20 0.48
SMN1; SMN2 Q16637 6/20 0.48
MAPT P10636 5/20 0.48
KDM4E B2RXH2 2/20 0.48
HSD17B10 Q99714 2/20 0.48
MEN1 O00255 2/20 0.48
USP2 O75604 2/20 0.48
ALDH1A1 P00352 2/20 0.48
KMT2A Q03164 2/20 0.48
GAA P10253 1/20 0.48
HPGD P15428 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.45
NPC1 O15118 5/20 0.44
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
S1PR1 P21453 3/20 0.38
STAT3 P40763 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
SCHEMBL8080399 1.00 RARB (0.51) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8079648 1.00 RARB (0.51) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8065431 1.00 RARB (0.51) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8064916 1.00 RARB (0.51) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8074909 1.00 RARB (0.51) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8065236 0.94 RARB (0.50) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8075276 0.94 RARB (0.50) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8065151 0.94 RARB (0.50) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8078159 0.94 RARB (0.50) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8075916 0.94 RARB (0.50) RARBRAB9ASMN1; SMN2MAPTKDM4E

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 2 patents. 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
US-5454976-A Optical active mixture comprising a fluoro-alkyl phenyl pyrimidine compounds; high contrast ratio, fast response time; optical switches, printer shutter arrays TAKASAGO INTERNATIONAL CORPORATION (JP) 1995-10-03 US disclosed