SCHEMBL3784249

SCHEMBL3784249

C=C(C)C(=O)Oc1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
LMNA P02545 3/20 0.48
POLB P06746 1/20 0.48
HTT P42858 2/20 0.45
TDP1 Q9NUW8 2/20 0.44
ALDH1A1 P00352 7/20 0.44
GPR35 Q9HC97 5/20 0.44
CREBBP Q92793 1/20 0.43
MAPT P10636 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MITF O75030 1/20 0.43
CCR6 P51684 1/20 0.43
HPGD P15428 3/20 0.42
MAPK1 P28482 2/20 0.42
HIF1A Q16665 2/20 0.42
KDM4E B2RXH2 1/20 0.42
TTR P02766 1/20 0.42
CYP1A2 P05177 1/20 0.42

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
SCHEMBL4451197 0.94 KMT2A (0.47) KMT2AMEN1LMNAPOLBHTT
SCHEMBL4351249 0.86 ALDH1A1 (0.50) KMT2AMEN1LMNAPOLBHTT
Methacrylic Acid SCHEMBL27555674 0.84 KMT2A (0.44) KMT2AMEN1LMNAPOLBHTT
SCHEMBL9420507 0.83 TDP1 (0.69) KMT2AMEN1LMNAPOLBHTT
SCHEMBL11563856 0.83 KMT2A (0.52) KMT2AMEN1LMNAPOLBHTT
SCHEMBL4907649 0.81 TTR (0.50) KMT2AMEN1LMNAPOLBTDP1
Methacrylic Acid SCHEMBL27456429 0.80 TDP1 (0.65) KMT2AMEN1LMNAPOLBHTT
SCHEMBL1221505 0.79 TDP1 (0.54) KMT2AMEN1LMNAPOLBHTT
SCHEMBL619394 0.79 ALDH1A1 (0.57) KMT2AMEN1LMNAPOLBHTT
SCHEMBL30460084 0.79 ALDH1A1 (0.57) KMT2AMEN1LMNAPOLBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100272920-A1 Radiation Curable System Garnett, John Lyndon (AU) 2010-10-28 US disclosed
CN-1120857-C Electrical insulating resin material, electrical insulating material, and electric wire and cable using same JAPAN POLYOLEFINS CO LTD (JP) 2003-09-10 CN disclosed
CN-1318088-A Electrical insulating resin material, electrical insulating material, and electric wire and cable using same JAPAN BOLYOLEFINS CO LTD (JP) 2001-10-17 CN disclosed
EP-0674325-A2 Electrically insulating polymer composition and wire or cable using the same Nippon Petrochemicals Co., Ltd. (JP) 1995-09-27 EP disclosed
US-5304619-A Containing nitrile or nitro polar groups; high voltage NIPPON PETROCHEMICALS CO., LTD. (JP) 1994-04-19 US disclosed
EP-0463402-A2 Ethylene polymers or copolymers having improved insulating properties, compositions, and power cables made therefrom NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-01-02 EP disclosed
US-4156034-A COPOLYMER OF ACRYLIC ESTER AND STYRENE DERIVATIVE AS COATING AGENT HITACHI, LTD. (JP) 1979-05-22 US disclosed