SCHEMBL15224809

SCHEMBL15224809

CC(C)CCC(c1ccc(OC#N)cc1)c1ccccc1OC#N

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.44
MEN1 O00255 8/20 0.44
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
ALDH1A1 P00352 6/20 0.37
LMNA P02545 5/20 0.37
HPGD P15428 1/20 0.37
MAPT P10636 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HTT P42858 2/20 0.34
PBRM1 Q86U86 1/20 0.33
MITF O75030 1/20 0.32
TP53 P04637 1/20 0.32
GAA P10253 1/20 0.32
SGMS2 Q8NHU3 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
AR P10275 1/20 0.31

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
SCHEMBL15224602 0.92 KMT2A (0.42) KMT2AMEN1OPRM1OPRD1ALDH1A1
SCHEMBL15224668 0.88 KMT2A (0.41) KMT2AMEN1OPRM1OPRD1ALDH1A1
SCHEMBL15224532 0.88 MEN1 (0.39) KMT2AMEN1OPRM1OPRD1ALDH1A1
SCHEMBL15224464 0.88 MEN1 (0.42) KMT2AMEN1OPRM1OPRD1ALDH1A1
SCHEMBL15224419 0.86 MEN1 (0.39) KMT2AMEN1OPRM1OPRD1ALDH1A1
SCHEMBL15224585 0.85 MEN1 (0.41) KMT2AMEN1OPRM1OPRD1ALDH1A1
SCHEMBL15224727 0.84 MEN1 (0.40) KMT2AMEN1OPRM1OPRD1ALDH1A1
SCHEMBL15224764 0.84 CYP19A1 (0.35) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL15224547 0.83 MEN1 (0.39) KMT2AMEN1OPRM1OPRD1ALDH1A1
SCHEMBL15225215 0.83 MEN1 (0.38) KMT2AMEN1OPRM1OPRD1ALDH1A1

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
US-9453126-B2 Cyanate ester compound, curable resin composition containing cyanate ester compound, and cured product thereof MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2016-09-27 US claimed
US-9453126-B2 Cyanate ester compound, curable resin composition containing cyanate ester compound, and cured product thereof MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2016-09-27 US disclosed
US-20130281640-A1 CYANATE ESTER COMPOUND, CURABLE RESIN COMPOSITION CONTAINING CYANATE ESTER COMPOUND, AND CURED PRODUCT THEREOF MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2013-10-24 US disclosed
EP-2634205-A1 CYANATE ESTER COMPOUND, CURABLE RESIN COMPOSITION CONTAINING CYANATE ESTER COMPOUND, AND CURED PRODUCT THEREOF Mitsubishi Gas Chemical Company, Inc. (JP) 2013-09-04 EP disclosed