SCHEMBL4448972

SCHEMBL4448972

C=C(C)C(=O)OCCSc1ccc(C(=O)c2ccccc2SCCOC(=O)C(=C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 6/20 0.40
POLB P06746 3/20 0.40
ALOX15 P16050 1/20 0.40
ELANE P08246 1/20 0.40
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 3/20 0.39
HTT P42858 2/20 0.39
APEX1 P27695 1/20 0.39
ALDH1A1 P00352 5/20 0.38
HPGD P15428 2/20 0.38
ALOX12 P18054 2/20 0.38
PKM P14618 1/20 0.38
PTGS2 P35354 3/20 0.38
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL10050686 0.86 ELANE (0.55) HSD17B10POLBELANEKMT2ATDP1
SCHEMBL5424465 0.86 ELANE (0.41) HSD17B10POLBALOX15ELANEKMT2A
SCHEMBL2865794 0.86 TDP1 (0.47) HSD17B10POLBELANEKMT2ATDP1
SCHEMBL21889383 0.82 TDP1 (0.44) HSD17B10POLBELANEKMT2ATDP1
SCHEMBL2392778 0.80 MTNR1A (0.50) HSD17B10POLBELANEKMT2ATDP1
SCHEMBL24565140 0.78 RAB9A (0.43) HSD17B10POLBALOX15KMT2ATDP1
SCHEMBL3134843 0.77 THRB (0.43) HSD17B10POLBKMT2ATDP1HTT
SCHEMBL24565132 0.76 ALDH1A1 (0.45) POLBTDP1HTTAPEX1ALDH1A1
SCHEMBL24753941 0.76 MTNR1A (0.57) HSD17B10POLBALOX15PTGS2
SCHEMBL21889384 0.75 POLB (0.52) POLBELANEKMT2ATDP1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7569619-B2 Radiation-curable resin composition and cured product thereof MITSUBISHI CHEMICAL CORPORATION (JP) 2009-08-04 US disclosed
US-20080102262-A1 Radiation Curable Composition and Curing Product Thereof, and Laminate Including the Same MITSUBISHI CHEMICAL CORPORATION (JP) 2008-05-01 US disclosed
US-20070231527-A1 Optical Recording Medium and Method for Producing Same MITSUBISHI KAGAKU MEDIA CO., LTD. (JP) 2007-10-04 US disclosed
EP-1811517-A1 OPTICAL RECORDING MEDIUM AND METHOD FOR PRODUCING SAME Mitsubishi Kagaku Media Co., Ltd. (JP) 2007-07-25 EP disclosed
US-20050267230-A1 Radiation-curable resin composition and cured product thereof MITSUBISHI CHEMICAL CORPORATION (JP) 2005-12-01 US disclosed
EP-1561765-A1 RADIATION CURING RESIN COMPOSITION AND CURED PRODUCT THEREOF Mitsubishi Chemical Corporation (JP) 2005-08-10 EP disclosed