SCHEMBL279440

SCHEMBL279440

CC(=O)CC(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.63
GSK3B P49841 1/20 0.62
CES1 P23141 2/20 0.57
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
NPC1 O15118 1/20 0.54
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
TSHR P16473 1/20 0.53
ALDH1A1 P00352 1/20 0.53
MMP8 P22894 1/20 0.53
PKM P14618 1/20 0.53
HSD11B1 P28845 1/20 0.50
CES2 O00748 1/20 0.50

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
SCHEMBL17973393 0.95 MAPK1 (0.58) MAPK1GSK3BCES1MEN1KMT2A
SCHEMBL11510574 0.88 GSK3B (0.71) MAPK1GSK3BCES1MEN1KMT2A
SCHEMBL7208394 0.83 GSK3B (0.65) MAPK1GSK3BCES1MEN1KMT2A
SCHEMBL11818596 0.82 MEN1 (0.59) MAPK1GSK3BCES1MEN1KMT2A
SCHEMBL5474416 0.82 MEN1 (0.59) MAPK1GSK3BCES1MEN1KMT2A
SCHEMBL2003577 0.82 KMT2A (0.52) MAPK1GSK3BCES1MEN1KMT2A
SCHEMBL6756989 0.81 TSHR (0.63) MAPK1GSK3BCES1MEN1KMT2A
SCHEMBL873998 0.81 GSK3B (0.62) MAPK1GSK3BCES1MEN1KMT2A
SCHEMBL9207986 0.81 CES1 (0.70) MAPK1GSK3BCES1MEN1KMT2A
SCHEMBL671514 0.81 GSK3B (0.67) MAPK1GSK3BCES1CA1CA2

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12269915-B2 Non aqueous crosslinkable composition ALLNEX NETHERLANDS BV (NL) 2025-04-08 US disclosed
US-20240279493-A1 NON AQUEOUS CROSSLINKABLE COMPOSITION ALLNEX NETHERLANDS B.V. (NL) 2024-08-22 US disclosed
EP-4077455-B1 NON AQUEOUS CROSSLINKABLE COMPOSITION ALLNEX NETHERLANDS BV (NL) 2024-06-12 EP disclosed
CN-114846049-B Nonaqueous crosslinkable compositions 湛新荷兰有限公司 2024-05-24 CN disclosed
EP-4359482-A1 NON AQUEOUS CROSSLINKABLE COMPOSITION Allnex Netherlands B.V. (NL) 2024-05-01 EP disclosed
CN-117545811-A Non-aqueous crosslinkable compositions 湛新荷兰有限公司 2024-02-09 CN disclosed
CN-113544181-B Non-aqueous crosslinkable compositions 湛新荷兰有限公司 2023-08-08 CN disclosed
US-20230183521-A1 NON-AQUEOUS CROSS-LINKABLE COMPOSITION ALLNEX RESINS (CHINA) CO., LTD. (CN) 2023-06-15 US disclosed
EP-4149983-A1 NON-AQUEOUS CROSS-LINKABLE COMPOSITION Allnex Resins (China) Co., Ltd. (CN) 2023-03-22 EP disclosed
US-20230026705-A1 NON AQUEOUS CROSSLINKABLE COMPOSITION ALLNEX NETHERLANDS B.V. (NL) 2023-01-26 US disclosed
EP-0168037-B1 1-6-NAPHTHYRIDIN-2(1H)-ONES USEFUL AS CARDIOTONICS STERLING DRUG INC. (US) 1990-02-07 EP disclosed
EP-0102720-B1 POLYURETHANE COATING OR ADHESIVE COMPOSITIONS AND METHODS OF USING THEM ROHM AND HAAS COMPANY (US) 1988-07-13 EP disclosed
US-4668799-A Anti-hepatitis and anti-cirrhotic 1,3-dithiol-2-ylidene derivatives, and pharmaceutical compositions therefor BANYU PHARMACEUTICAL CO., LTD. (JP) 1987-05-26 US disclosed
US-4599344-A Quinuclidines and quinuclidinium salts as antiarrhythmic agents SCHERING A.G. (DE) 1986-07-08 US disclosed
US-4571420-A ADDITION POLYMERS WITH UNSATURATED MERCAPTIANS AND VANADIUM COMPUOND ROHM AND HAAS COMPANY (US) 1986-02-18 US disclosed
EP-0168037-A2 1-6-Naphthyridin-2(1H)-ones useful as cardiotonics STERLING DRUG INC. (US) 1986-01-15 EP disclosed
US-4560691-A 5-(Phenyl)-1,6-naphthyridin-2(1H)-ones, their cardiotonic use and preparation STERLING DRUG INC. (US) 1985-12-24 US disclosed
EP-0102720-A1 Polyurethane coating or adhesive compositions and methods of using them ROHM AND HAAS COMPANY (US) 1984-03-14 EP disclosed
US-4426510-A Polyurethane preparation using organo-zinc catalyst and time-lapse modifier ROHM AND HAAS COMPANY (US) 1984-01-17 US disclosed
US-4009150-A CHELATE COMPOUNDS, REDUCING AGENTS, INITIATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-02-22 US disclosed