SCHEMBL304540

SCHEMBL304540

Nc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.52
ALDH1A1 P00352 5/20 0.52
TSHR P16473 3/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
CYP3A4 P08684 2/20 0.52
POLB P06746 2/20 0.52
MAPT P10636 2/20 0.52
ALOX15 P16050 1/20 0.52
USP2 O75604 1/20 0.46
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46
GPR35 Q9HC97 3/20 0.45
LMNA P02545 3/20 0.44
TXNRD1 Q16881 1/20 0.43
TXNRD3 Q86VQ6 1/20 0.43
TXNRD2 Q9NNW7 1/20 0.43
PKM P14618 1/20 0.41

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
SCHEMBL27832802 0.88 MEN1 (0.53) TDP1ALDH1A1TSHRMEN1KMT2A
SCHEMBL3302919 0.85 TSHR (0.56) TDP1ALDH1A1TSHRCYP3A4GPR35
SCHEMBL597745 0.84 ALDH1A1 (0.50) TDP1ALDH1A1TSHRMEN1KMT2A
SCHEMBL2145662 0.84 ALDH1A1 (0.50) TDP1ALDH1A1TSHRMEN1KMT2A
SCHEMBL28111354 0.83 NSD2 (0.43) TDP1ALDH1A1TSHRMEN1KMT2A
SCHEMBL27540387 0.83 ALDH1A1 (0.48) TDP1ALDH1A1TSHRMEN1KMT2A
SCHEMBL11048248 0.83 ALDH1A1 (0.48) TDP1ALDH1A1TSHRMEN1KMT2A
SCHEMBL2006430 0.81 TSHR (0.53) TDP1ALDH1A1TSHRMEN1KMT2A
SCHEMBL11047029 0.81 TDP1 (0.53) TDP1ALDH1A1TSHRMEN1KMT2A
SCHEMBL2763390 0.81 GPR35 (0.52) TDP1ALDH1A1TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122055148-A Conjugates, compositions and methods for treating influenza 珀杜研究基金会 2026-05-15 CN claimed
WO-2025085675-A1 CONJUGATES, COMPOSITIONS AND METHODS FOR TREATING RSV INFECTION NIEDRAUER MARY LYNN (US) 2025-04-24 WO claimed
WO-2025085664-A1 CONJUGATES, COM POSITIONS AND METHODS FOR TREATING INFLUENZA NIEDRAUER MARY LYNN (US) 2025-04-24 WO claimed
CN-113667132-B Hyperbranched polyallylamine compound, preparation method thereof, post-functionalization method and application 华南理工大学 2022-05-24 CN claimed
CN-113667132-A Hyperbranched polyallylamine compound, preparation method thereof, post-functionalization method and application 华南理工大学 2021-11-19 CN claimed
US-10766830-B2 Compositions with solid fuel loaded on graphene foams PURDUE RESEARCH FOUNDATION (US) 2020-09-08 US claimed
CN-108155020-B Graphene composite material and its preparation method and application 中国石油化工股份有限公司 2019-10-25 CN claimed
US-20180282240-A1 COMPOSITIONS WITH SOLID FUEL LOADED ON GRAPHENE FOAMS PURDUE RESEARCH FOUNDATION (US) 2018-10-04 US claimed
CN-108155020-A Graphene composite material and its preparation method and application 中国石油化工股份有限公司 2018-06-12 CN claimed
US-8091479-B1 Fluid blade disablement tool SANDIA CORPORATION (US) 2012-01-10 US claimed
CN-1124012-A Arylating medicaments RADOPATH LTD (GB) 1996-06-05 CN claimed
EP-0710225-A1 FLUORESCENCE DETERMINATION OF THE ACTIVITY OF LIPOLYTIC ENZYMES PROGEN Biotechnik GmbH (DE) 1996-05-08 EP claimed
EP-0700287-A1 ARYLATING MEDICAMENTS RADOPATH LIMITED (GB) 1996-03-13 EP claimed
WO-1995032181-A1 FLUORESCENCE DETERMINATION OF THE ACTIVITY OF LIPOLYTIC ENZYMES PROGEN BIOTECHNIK GMBH (DE) 1995-11-30 WO claimed
WO-1994027584-A2 ARYLATING MEDICAMENTS RADOPATH LIMITED (GB) 1994-12-08 WO claimed
EP-0125166-B1 COLD-MOULDABLE EXPLOSIVE COMPOSITION AND PROCESS FOR ITS PREPARATION COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 1987-04-01 EP claimed
EP-0022313-B1 RECORDING MEDIUM, METHOD OF MAKING A RECORDING OR A STAMPER AND RECORDING APPARATUS DISCOVISION ASSOCIATES (US) 1985-11-21 EP claimed
EP-0156040-A2 A method and apparatus for recording on a movable recording medium by using a light beam, and the medium for such a recording DISCOVISION ASSOCIATES (US) 1985-10-02 EP claimed
EP-0103892-A2 Optical recording medium and method of making same DISCOVISION ASSOCIATES (US) 1984-03-28 EP claimed
EP-0022313-A1 Recording medium, method of making a recording or a stamper and recording apparatus DISCOVISION ASSOCIATES (US) 1981-01-14 EP claimed