SCHEMBL8552346

SCHEMBL8552346

O=C(OCc1ccccc1)c1cc([N+](=O)[O-])c(F)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
COMT P21964 1/20 0.46
ALDH1A1 P00352 2/20 0.46
RAB9A P51151 2/20 0.45
POLB P06746 1/20 0.45
KMT2A Q03164 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
PTGES O14684 1/20 0.45
NPC1 O15118 1/20 0.44
LMNA P02545 2/20 0.43
CTSV O60911 1/20 0.43
CTSL P07711 1/20 0.43
MITF O75030 1/20 0.43
SLC6A2 P23975 1/20 0.42
SLC6A3 Q01959 1/20 0.42
MEN1 O00255 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
SCHEMBL1972473 0.89 ALDH1A1 (0.49) L3MBTL1COMTALDH1A1RAB9APOLB
SCHEMBL15610320 0.83 RAB9A (0.53) ALDH1A1RAB9AKMT2ANPC1MEN1
SCHEMBL3064007 0.81 LMNA (0.53) ALDH1A1POLBKMT2ANPC1LMNA
SCHEMBL1972609 0.81 RAB9A (0.54) L3MBTL1COMTALDH1A1RAB9AKMT2A
SCHEMBL25317752 0.80 ITGB1 (0.48) ALDH1A1RAB9AKMT2ATDP1NPC1
SCHEMBL4132618 0.80 ALDH1A1 (0.64) L3MBTL1ALDH1A1RAB9APOLBKMT2A
SCHEMBL8555147 0.80 ALDH1A1 (0.50) PKML3MBTL1ALDH1A1RAB9APOLB
SCHEMBL31448243 0.80 ALDH1A1 (0.50) PKML3MBTL1ALDH1A1RAB9APOLB
SCHEMBL1978714 0.79 MAPT (0.56) ALDH1A1RAB9AKMT2ATDP1NPC1
SCHEMBL6312189 0.79 MITF (0.64) ALDH1A1RAB9AKMT2ATDP1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12577216-B2 Triazine benzoate compound and application thereof SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2026-03-17 US disclosed
CN-119613399-A Tetra-substituted benzoate compound containing alkoxy acetate substituent and application thereof 江西天宇化工有限公司 2025-03-14 CN disclosed
CN-115103837-B Triazine benzoate compound and application thereof 沈阳中化农药化工研发有限公司 2023-12-29 CN disclosed
US-20230227415-A1 TRIAZINE BENZOATE COMPOUND AND APPLICATION THEREOF SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2023-07-20 US disclosed
US-20230227415-A1 TRIAZINE BENZOATE COMPOUND AND APPLICATION THEREOF SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2023-07-20 US disclosed
US-20230227415-A1 TRIAZINE BENZOATE COMPOUND AND APPLICATION THEREOF SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2023-07-20 US disclosed
EP-4169910-A1 TRIAZINE BENZOATE COMPOUND AND APPLICATION THEREOF Shenyang Sinochem Agrochemicals R & D Co., Ltd. (CN) 2023-04-26 EP disclosed
EP-4169910-A1 TRIAZINE BENZOATE COMPOUND AND APPLICATION THEREOF Shenyang Sinochem Agrochemicals R & D Co., Ltd. (CN) 2023-04-26 EP disclosed
CN-115103837-A Triazine benzoate compound and application thereof 沈阳中化农药化工研发有限公司 2022-09-23 CN disclosed
WO-2021259224-A1 TRIAZINE BENZOATE COMPOUND AND APPLICATION THEREOF 沈阳中化农药化工研发有限公司 2021-12-30 WO disclosed
EP-0863142-A1 Heterocyclic herbicides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-09-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230227415-A1 TRIAZINE BENZOATE COMPOUND AND APPLICATION THEREOF NOTUM, CYP3A5, DDT PKM 1702/4885L3MBTL1 2827/4885COMT 1115/4885
US-12577216-B2 Triazine benzoate compound and application thereof CBR3, CBR1, CNPY2 PKM 2571/4885L3MBTL1 453/4885COMT 989/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.