SCHEMBL9341963

SCHEMBL9341963

NC(=O)C(=Cc1ccco1)[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.54
MAPT P10636 4/20 0.54
TDP1 Q9NUW8 4/20 0.54
MEN1 O00255 3/20 0.54
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
POLB P06746 5/20 0.43
L3MBTL1 Q9Y468 4/20 0.42
KDM4E B2RXH2 2/20 0.42
GAA P10253 1/20 0.42
THRB P10828 1/20 0.42
RECQL P46063 1/20 0.42
HCAR2 Q8TDS4 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
ALOX5 P09917 1/20 0.38
MASP2 O00187 1/20 0.38
F2 P00734 1/20 0.38
HTT P42858 2/20 0.38

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
SCHEMBL9341959 1.00 KMT2A (0.54) KMT2AMAPTTDP1MEN1TSHR
SCHEMBL11372649 0.84 MAPT (0.47) KMT2AMAPTTDP1MEN1TSHR
SCHEMBL4206177 0.78 FBP1 (0.53) KMT2AMAPTTDP1MEN1TSHR
SCHEMBL4206174 0.78 FBP1 (0.53) KMT2AMAPTTDP1MEN1TSHR
SCHEMBL3653102 0.77 RAB9A (0.49) KMT2AMAPTTDP1MEN1TSHR
SCHEMBL4729615 0.75 MAPT (0.80) KMT2AMAPTTDP1MEN1TSHR
SCHEMBL4215747 0.75 FBP1 (0.53) KMT2AMAPTTDP1MEN1TSHR
SCHEMBL22528743 0.75 FBP1 (0.53) KMT2AMAPTTDP1MEN1TSHR
SCHEMBL22528744 0.75 FBP1 (0.53) KMT2AMAPTTDP1MEN1TSHR
SCHEMBL4215748 0.75 FBP1 (0.53) KMT2AMAPTTDP1MEN1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5330565-A And thermoplastic resin NIPPON PETROCHEMICALS COMPANY LIMITED (JP) 1994-07-19 US disclosed
EP-0217275-B1 METHOD FOR PRODUCING LAMINATED MATERIAL NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-04-15 EP disclosed
EP-0215480-B1 ACTIVE AGENT-CONTAINING LAMINATED MATERIAL AND METHOD FOR PRODUCING THE SAME Nippon Petrochemicals Co., Ltd. (JP) 1992-01-29 EP disclosed
EP-0059460-B2 AN INSECTICIDE AND A PROCESS FOR ITS PREPARATION SHIONOGI & CO., LTD. (JP) 1991-11-27 EP disclosed
EP-0228710-B1 METHOD FOR PRODUCING ACTIVE AGENT-CONTAINING LAMINATED PAPER Nippon Petrochemicals Co., Ltd. (JP) 1991-04-10 EP disclosed
US-4747902-A Method for producing laminated material NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-05-31 US disclosed
EP-0059460-B1 AN INSECTICIDE AND A PROCESS FOR ITS PREPARATION SHIONOGI & CO., LTD. (JP) 1988-05-18 EP disclosed
US-4713241-A AEROBIC FERMENTATION THEN SPRAY DRYING SHIONOGI & CO., LTD. (JP) 1987-12-15 US disclosed
EP-0228710-A1 Method for producing active agent-containing laminated paper Nippon Petrochemicals Co., Ltd. (JP) 1987-07-15 EP disclosed
EP-0217275-A2 Method for producing laminated material NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1987-04-08 EP disclosed
EP-0215480-A2 Active agent-containing laminated material and method for producing the same Nippon Petrochemicals Co., Ltd. (JP) 1987-03-25 EP disclosed
EP-0059460-A2 An insecticide and a process for its preparation SHIONOGI & CO., LTD. (JP) 1982-09-08 EP disclosed