SCHEMBL6535747

SCHEMBL6535747

CCOC(=O)Nc1ccccc1[N+](=O)[O-]

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.62
MEN1 O00255 2/20 0.62
ALDH1A1 P00352 7/20 0.62
TP53 P04637 1/20 0.59
HPGD P15428 1/20 0.56
POLB P06746 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
RAB9A P51151 2/20 0.53
NPC1 O15118 1/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
GAA P10253 2/20 0.52
MAPT P10636 1/20 0.52
MAPK1 P28482 1/20 0.52
KCNMA1 Q12791 1/20 0.51
PDK1 Q15118 1/20 0.51
PDK2 Q15119 1/20 0.51
PDK3 Q15120 1/20 0.51
PDK4 Q16654 1/20 0.51

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
SCHEMBL11439031 0.89 ALDH1A1 (0.52) KMT2AMEN1ALDH1A1TP53HPGD
SCHEMBL21059154 0.88 KMT2A (0.67) KMT2AMEN1ALDH1A1TP53SMN1; SMN2
SCHEMBL16446577 0.88 KMT2A (0.60) KMT2AMEN1ALDH1A1TP53POLB
SCHEMBL21059235 0.86 KMT2A (0.61) KMT2AMEN1ALDH1A1TP53SMN1; SMN2
SCHEMBL3641699 0.85 ALDH1A1 (0.60) KMT2AMEN1ALDH1A1TP53SMN1; SMN2
SCHEMBL5922169 0.85 KMT2A (0.66) KMT2AMEN1ALDH1A1TP53POLB
SCHEMBL12474439 0.85 KMT2A (0.50) KMT2AMEN1ALDH1A1TP53HPGD
SCHEMBL21059249 0.85 KMT2A (0.60) KMT2AMEN1ALDH1A1TP53SMN1; SMN2
SCHEMBL25405076 0.84 KMT2A (0.57) KMT2AMEN1ALDH1A1TP53POLB
SCHEMBL3659889 0.84 KMT2A (0.65) KMT2AMEN1ALDH1A1TP53SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113105516-A Photocleavable fluorescent labeling compounds and uses 深圳市真迈生物科技有限公司 2021-07-13 CN claimed
EP-4556480-A1 COMPOUNDS CONSTITUTING C20-MODIFIED SALINOMYCIN DERIVATIVES, A METHOD FOR OBTAINING THE SAME, A COMPOSITION CONTAINING THE SAME AND A USE OF SAID COMPOUNDS Fileclo Spolka Z Ograniczona Odpowiedzialnoscia (PL) 2025-05-21 EP disclosed
EP-4380939-A1 COMPOUNDS CONSTITUTING C20-MODIFIED SALINOMYCIN DERIVATIVES, A METHOD FOR OBTAINING THE SAME, A COMPOSITION CONTAINING THE SAME AND A USE OF SAID COMPOUNDS Fileclo Spolka Z Ograniczona Odpowiedzialnoscia (PL) 2024-06-12 EP disclosed
CN-118139851-A Antitumor compounds 法马马有限公司 2024-06-04 CN disclosed
CN-112672873-B Resin composition suitable for printing and printing method 莱奥本矿业大学 2024-02-02 CN disclosed
WO-2023012323-A1 COMPOUNDS CONSTITUTING C20-MODIFIED SALINOMYCIN DERIVATIVES, A METHOD FOR OBTAINING THE SAME, A COMPOSITION CONTAINING THE SAME AND A USE OF SAID COMPOUNDS FILECLO SPOLKA Z OGRANICZONA ODPOWIEDZIALNOSCIA (PL) 2023-02-09 WO disclosed
CN-112789161-B Method for manufacturing an optical element and optical element obtained thereby 依视路国际公司 2022-12-23 CN disclosed
CN-114615999-A Drug antibody conjugates 法马马有限公司 2022-06-10 CN disclosed
CN-113226377-A Antibody drug conjugates comprising an eltrinastine derivative 法马马有限公司 2021-08-06 CN disclosed
CN-113166102-A Anticancer compounds 法马马有限公司 2021-07-23 CN disclosed
WO-2002071155-A1 THERMOSETTING ANTI-REFLECTIVE COATINGS COMPRISING ARYL URETHANES OF HYDROXYPROPYL CELLULOSE BREWER SCIENCE, INC. (US) 2002-09-12 WO disclosed
US-20010031428-A1 Made by reacting a hydroxyalkyl cellulose with an aryl isocyanate such as phenyl isocyanate; coatings have high etch rate and optical density ARMY, SECRETARY OF THE 2001-10-18 US disclosed
US-5466817-A Benzopyran derivatives and heterocyclic analogs thereof as antiischemic agents E.R. SQUIBB & SONS, INC. (US) 1995-11-14 US disclosed
US-5393771-A 4-substituted benzopyran and related compounds BRISOL-MYERS SQUIBB COMPANY (US) 1995-02-28 US disclosed
EP-0624581-A2 4-Substituted benzopyran and related compounds useful as pharmaceutical agents BRISTOL-MYERS SQUIBB COMPANY (US) 1994-11-17 EP disclosed
US-5276168-A Benzopyran derivatives and heterocyclic analogs thereof as antiischemic agents E. R. SQUIBB & SONS, INC. (US) 1994-01-04 US disclosed
EP-0462761-A2 Benzopyran derivatives and heterocyclic analogs thereof as antiischemic agents E.R. SQUIBB & SONS, INC. (US) 1991-12-27 EP disclosed
US-4487713-A HEAT TREATMENT WITH TITANIUM, TIN, ANTIMONY OR ZIRCONIUM COMPOUND EXXON RESEARCH & ENGINEERING CO. (US) 1984-12-11 US disclosed
US-4081472-A CATALYTIC, FROM A CARBAMATE MITSUI TOATSU CHEMICALS INC. (JA) 1978-03-28 US disclosed
US-3962302-A Production of isocyanates from esters of carbamic acids (urethanes) ATLANTIC RICHFIELD COMPANY (US) 1976-06-08 US disclosed