SCHEMBL3086799

SCHEMBL3086799

O=C(O)c1ccc(F)c([N+](=O)[O-])c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2C19 P33261 2/20 0.48
CYP2D6 P10635 1/20 0.48
CDK2 P24941 2/20 0.45
TSHR P16473 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CASP1 P29466 1/20 0.43
CYP3A4 P08684 2/20 0.40
ALOX15 P16050 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
GRIK1 P39086 1/20 0.39
TP53 P04637 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 2/20 0.38
KMT2A Q03164 2/20 0.38
HPGD P15428 1/20 0.37

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
SCHEMBL3052008 0.86 ALDH1A1 (0.40) ALDH1A1CYP1A2CYP2C19CYP2D6CDK2
SCHEMBL18306112 0.82 ALDH1A1 (0.42) ALDH1A1CYP1A2CYP2C19CYP2D6CDK2
SCHEMBL4960492 0.82 ALDH1A1 (0.42) ALDH1A1CYP1A2CYP2C19CYP2D6CDK2
SCHEMBL30729473 0.82 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP2C19CYP2D6CDK2
SCHEMBL8668862 0.82 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP2C19CYP2D6CDK2
SCHEMBL28789360 0.81 KCNH2 (0.38) ALDH1A1CYP1A2CYP2C19CYP2D6TSHR
SCHEMBL611879 0.81 ALDH1A1 (0.49) ALDH1A1CYP1A2CYP2C19CYP2D6CDK2
SCHEMBL21750002 0.81 ALDH1A1 (0.41) ALDH1A1CYP1A2CYP2C19CYP2D6CDK2
SCHEMBL8063523 0.81 ALDH1A1 (0.49) ALDH1A1CYP1A2CYP2C19CYP2D6CDK2
SCHEMBL28252852 0.81 ALB (0.47) ALDH1A1CDK2TSHRSMN1; SMN2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4313954-B1 PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOIC ACID ADAMA AGAN LTD (IL) 2025-10-15 EP claimed
US-20240217915-A1 PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOIC ACID ADAMA AGAN LTD. (IL) 2024-07-04 US claimed
EP-4313954-A1 PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOIC ACID Adama Agan Ltd. (IL) 2024-02-07 EP claimed
CN-117062805-A Preparation of 2-chloro-4-fluoro-5-nitrobenzoic acid 安道麦阿甘有限公司 2023-11-14 CN claimed
US-20260085051-A1 PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOIC ACID ADAMA AGAN LTD. (IL) 2026-03-26 US disclosed
EP-4313954-B1 PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOIC ACID ADAMA AGAN LTD (IL) 2025-10-15 EP disclosed
CN-119790033-A Preparation of 2-chloro-4-fluoro-5-nitrobenzoic acid 安道麦阿甘有限公司 2025-04-08 CN disclosed
US-20240217915-A1 PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOIC ACID ADAMA AGAN LTD. (IL) 2024-07-04 US disclosed
US-20240217915-A1 PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOIC ACID ADAMA AGAN LTD. (IL) 2024-07-04 US disclosed
WO-2024047648-A1 PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOIC ACID ADAMA AGAN LTD. (IL) 2024-03-07 WO disclosed
EP-4313954-A1 PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOIC ACID Adama Agan Ltd. (IL) 2024-02-07 EP disclosed
EP-4313954-A1 PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOIC ACID Adama Agan Ltd. (IL) 2024-02-07 EP disclosed
WO-2018141642-A1 PROCESS FOR THE PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOTRICHLORIDE BASF Agro B.V. (NL) 2018-08-09 WO disclosed
US-20120310010-A1 Method for producing sulfonamides BASF SE (DE) 2012-12-06 US disclosed
CN-101351443-B Process for preparing sulfonamides BASF SE 2012-11-28 CN disclosed
US-8263806-B2 Method for producing sulfonamides BASF SE (DE) 2012-09-11 US disclosed
US-20100228054-A1 Method for Producing Sulfonamides BASF SE (DE) 2010-09-09 US disclosed
CN-101351443-A Process for preparing sulfonamides BASF AG (DE) 2009-01-21 CN disclosed
EP-1957443-A2 METHOD FOR PRODUCING SULFONAMIDES BASF SE (DE) 2008-08-20 EP disclosed
WO-2007063028-A2 METHOD FOR PRODUCING SULFONAMIDES BASF SE (DE) 2007-06-07 WO 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 (4 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-20100228054-A1 Method for Producing Sulfonamides STS, MSRB3, SQOR ALDH1A1 1345/4885CYP1A2 207/4885CYP2C19 276/4885
US-20120310010-A1 Method for producing sulfonamides MSRB3, STS, TST ALDH1A1 2610/4885CYP1A2 590/4885CYP2C19 540/4885
US-20240217915-A1 PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOIC ACID CYP4F12, COXFA4, NDUFS5 ALDH1A1 500/4885CYP1A2 251/4885CYP2C19 421/4885
US-20260085051-A1 PREPARATION OF 2-CHLORO-4-FLUORO-5-NITROBENZOIC ACID FOSB, DDT, NPM1 ALDH1A1 1129/4885CYP1A2 320/4885CYP2C19 419/4885

“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.