SCHEMBL9358052

SCHEMBL9358052

CCCCCCCCCCCc1ccc(-c2ccc(-c3ncc(OC[C@@H](C)OC(=O)CCCCC)cn3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.49
MEN1 O00255 2/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.49
KMT2A Q03164 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 1/20 0.49
USP2 O75604 1/20 0.49
GAA P10253 1/20 0.49
HPGD P15428 1/20 0.49
HSD17B10 Q99714 1/20 0.49
RARA P10276 1/20 0.45
MTOR P42345 1/20 0.45
MGLL Q99685 1/20 0.45
CNR1 P21554 2/20 0.41
CNR2 P34972 2/20 0.41
NPC1 O15118 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 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
SCHEMBL9357746 1.00 RARB (0.49) RARBMEN1ALDH1A1MAPTKMT2A
SCHEMBL9361580 1.00 RARB (0.49) RARBMEN1ALDH1A1MAPTKMT2A
SCHEMBL9625668 0.99 RARB (0.50) RARBMEN1ALDH1A1MAPTKMT2A
SCHEMBL9624508 0.99 RARB (0.50) RARBMEN1ALDH1A1MAPTKMT2A
SCHEMBL9357494 0.98 RARB (0.49) RARBMEN1ALDH1A1MAPTKMT2A
SCHEMBL9625734 0.97 RARB (0.50) RARBMEN1ALDH1A1MAPTKMT2A
SCHEMBL9361599 0.96 RARB (0.49) RARBMEN1ALDH1A1MAPTKMT2A
SCHEMBL9361738 0.96 RARB (0.44) RARBMEN1ALDH1A1MAPTKMT2A
SCHEMBL9357412 0.95 RARB (0.42) RARBMEN1ALDH1A1MAPTKMT2A
SCHEMBL9624845 0.95 RARB (0.50) RARBMEN1ALDH1A1MAPTKMT2A

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