SCHEMBL11695

SCHEMBL11695

Nc1cc(F)c(F)cc1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
PTK2 Q05397 1/20 0.38
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA7 P43166 2/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
BRD4 O60885 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
CA13 Q8N1Q1 1/20 0.32
DPP4 P27487 2/20 0.31
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL29561976 1.00 ALDH1A1 (0.48) ALDH1A1PTK2CA12CA1CA2
SCHEMBL1099578 0.93 ALDH1A1 (0.53) ALDH1A1PTK2CA12CA1CA2
SCHEMBL5517381 0.89 ALDH1A1 (0.50) ALDH1A1PTK2CA12CA1CA2
Hydrochloric Acid SCHEMBL8638822 0.86 ALDH1A1 (0.48) ALDH1A1PTK2CA12CA1CA2
SCHEMBL24355980 0.86 PTK2 (0.57) ALDH1A1PTK2CA12CA1CA2
SCHEMBL102552 0.85 PTK2 (0.54) ALDH1A1PTK2CA12CA1CA2
SCHEMBL29363736 0.85 PTK2 (0.54) ALDH1A1PTK2CA12CA1CA2
Sulfuric Acid SCHEMBL23804110 0.84 CA1 (0.43) ALDH1A1CA12CA1CA2CA7
Hydrochloric Acid SCHEMBL10335452 0.81 PTK2 (0.50) ALDH1A1PTK2CA12CA1CA2
Hydrochloric Acid SCHEMBL10335450 0.81 PTK2 (0.50) ALDH1A1PTK2CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117384029-B Synthesis method of 2,4, 5-trifluoro phenylacetic acid 山东国邦药业有限公司 2024-02-20 CN claimed
CN-117466729-A Synthesis method of 2,4, 5-trifluoro phenylacetic acid 山东国邦药业有限公司 2024-01-30 CN claimed
CN-117384029-A Synthesis method of 2,4, 5-trifluoro phenylacetic acid 山东国邦药业有限公司 2024-01-12 CN claimed
CN-116891413-A Method for continuously preparing 2,4, 5-trifluoroaniline 山东东岳高分子材料有限公司 2023-10-17 CN claimed
US-20230183154-A1 PROCESS FOR THE PREPARATION OF 1-BROMO-2,4,5-TRIFLUOROBENZENE AARTI INDUSTRIES LIMITED (IN) 2023-06-15 US claimed
EP-4118065-A1 PROCESS FOR THE PREPARATION OF 1-BROMO-2,4,5-TRIFLUOROBENZENE Aarti Industries Limited (IN) 2023-01-18 EP claimed
CN-115551823-A Preparation method of 1-bromo-2,4,5-trifluorobenzene 阿尔第实业有限公司 2022-12-30 CN claimed
US-11530178-B2 Hyper-branched compounds, synthesis and uses thereof Memsift Innovations Pte. Ltd. (SG) 2022-12-20 US claimed
CN-114685398-A Cyclohexanothiadiazine compound and preparation method and application thereof 沈阳农业大学 2022-07-01 CN claimed
CN-110498730-B Synthetic method of 1,2, 4-trifluorobenzene 浙江吉泰新材料股份有限公司 2021-12-03 CN claimed
EP-1773768-A4 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2008-08-06 EP claimed
EP-1773768-A2 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS Exelixis, Inc. (US) 2007-04-18 EP claimed
WO-2006012642-A2 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS, INC. (US) 2006-02-02 WO claimed
CN-1558898-A Antiviral agent ��Ұ����ҩ��ʽ���� 2004-12-29 CN claimed
EP-1422218-A1 ANTIVIRAL AGENT SHIONOGI & CO., LTD. (JP) 2004-05-26 EP claimed
EP-0994849-B1 METHOD FOR PRODUCTION OF 2,4,5-TRIFLUOROBENZONITRILE BAYER AG (DE) 2002-09-04 EP claimed
US-6399807-B1 REACTING 2,4,5-TRIFLUOROANILINE WITH NITROSATING AGENT IN DILUENT BAYER AKTIEGESELLSCHAFT (DE) 2002-06-04 US claimed
EP-0994849-A1 METHOD FOR PRODUCTION OF 2,4,5-TRIFLUOROBENZONITRILE BAYER AG (DE) 2000-04-26 EP claimed
WO-1999001425-A1 METHOD FOR PRODUCTION OF 2,4,5-TRIFLUOROBENZONITRILE BAYER AKTIENGESELLSCHAFT (DE) 1999-01-14 WO claimed
US-4767757-A Acyloxythiophene-carboxamide fungicides, compositions and use BAYER AKTIENGESELLSCHAFT (DE) 1988-08-30 US claimed

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-11530178-B2 Hyper-branched compounds, synthesis and uses thereof MYC, FOSB, FOS ALDH1A1 2837/4885PTK2 214/4885CA12 2235/4885
US-20230183154-A1 PROCESS FOR THE PREPARATION OF 1-BROMO-2,4,5-TRIFLUOROBENZENE FLNB, SULT1E1, SPIN2B ALDH1A1 1050/4885PTK2 2024/4885CA12 2108/4885

“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.