SCHEMBL8443501

SCHEMBL8443501

C=CC(=O)OCCCCCCCCc1cnc(-c2ccc(CCCCCC(C)OC(=O)CC)cc2)nc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.42
THRB P10828 9/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
USP2 O75604 1/20 0.37
GAA P10253 1/20 0.37
HSD17B10 Q99714 1/20 0.37
THRA P10827 6/20 0.35
TSHR P16473 2/20 0.35
CYP3A4 P08684 1/20 0.35
HTT P42858 1/20 0.33
NPC1 O15118 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 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
SCHEMBL8444612 0.89 RARB (0.43) RARBTHRBMEN1KMT2AALDH1A1
SCHEMBL8441264 0.83 RARB (0.38) RARBTHRBMEN1KMT2AALDH1A1
SCHEMBL8441015 0.83 RARB (0.38) RARBTHRBMEN1KMT2AALDH1A1
SCHEMBL8444589 0.82 RARB (0.44) RARBMEN1KMT2AALDH1A1HPGD
SCHEMBL9097155 0.79 RARB (0.46) RARBMEN1KMT2AALDH1A1HPGD
SCHEMBL9234427 0.78 RARB (0.57) RARBTHRBMEN1KMT2AALDH1A1
SCHEMBL9237159 0.78 RARB (0.57) RARBTHRBMEN1KMT2AALDH1A1
SCHEMBL9240117 0.78 RARB (0.57) RARBTHRBMEN1KMT2AALDH1A1
SCHEMBL9236557 0.78 RARB (0.57) RARBTHRBMEN1KMT2AALDH1A1
SCHEMBL9241014 0.78 RARB (0.57) RARBTHRBMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0634469-B1 Compound having unsaturated side-chain, process for preparing the same, liquid crystalline polymer prepared from the same, liquid crystal mixture and display element SUMITOMO CHEMICAL CO (JP) 1999-10-06 EP disclosed
US-5662828-A Compound having unsaturated side chain, process for preparing the same, liquid crystalline polymer prepared from the same, liquid crystal mixture and display element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-09-02 US disclosed
US-5554317-A POLYSILOXANE LIQUID CRYSTALLINE POLYMERS FORMED BY GRAFT POLYMERIZING AT LEAST ONE UNSATURATED COMPOUND WITH ONE OR MORE AROMATIC OR HETEROAROMATIC RINGS, OPTIONAL ETHER GROUP AND OPTIONAL ASYMMETRIC C ON POLYALKYLHYDROSILOXANE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-09-10 US disclosed
EP-0634469-A1 Compound having unsaturated side-chain, process for preparing the same, liquid crystalline polymer prepared from the same, liquid crystal mixture and display element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-01-18 EP disclosed