SCHEMBL9357791

SCHEMBL9357791

CCCCCCCCCCc1cnc(-c2ccc(-c3ccc(OC[C@@H](C)OC(=O)CCCCC)cc3)cc2)nc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.55
RAB9A P51151 5/20 0.44
MAPT P10636 4/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KMT2A Q03164 2/20 0.44
HSD17B10 Q99714 2/20 0.44
USP2 O75604 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
CNR2 P34972 4/20 0.41
CNR1 P21554 2/20 0.41
NPC1 O15118 3/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
MGLL Q99685 1/20 0.40

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
SCHEMBL10702668 1.00 RARB (0.55) RARBRAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL9624350 0.99 RARB (0.56) RARBRAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL9361686 0.98 RARB (0.55) RARBRAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL10702596 0.98 RARB (0.55) RARBRAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL9625486 0.97 RARB (0.56) RARBRAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL10703432 0.96 RARB (0.55) RARBRAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL9357471 0.96 RARB (0.55) RARBRAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL9624559 0.95 RARB (0.56) RARBRAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL9625869 0.95 RARB (0.56) RARBRAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL9345188 0.94 RARB (0.47) RARBRAB9AMAPTL3MBTL1SMN1; SMN2

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-0289270-B1 Optically active 2-biphenylpyrimidine derivatives and liquid crystal compositions containing them CHISSO CORP (JP) 1994-12-14 EP disclosed
US-5059340-A For display mode CHISSO CORPORATION (JP) 1991-10-22 US disclosed
EP-0289270-A1 Optically active 2-biphenylpyrimidine derivatives and liquid crystal compositions containing them Chisso Corporation (JP) 1988-11-02 EP disclosed