SCHEMBL538501

SCHEMBL538501

O=S(=O)(Oc1ccccn1)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.44
PDE4C Q08493 3/20 0.44
PDE4D Q08499 3/20 0.44
KDM4E B2RXH2 3/20 0.37
LMNA P02545 2/20 0.37
P4HTM Q9NXG6 2/20 0.37
METAP1 P53582 2/20 0.37
BLM P54132 2/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
CCR1 P32246 1/20 0.37
CCR5 P51681 1/20 0.37
CCR8 P51685 1/20 0.37
HIF1A Q16665 1/20 0.37
DOHH Q9BU89 1/20 0.37
PTGS2 P35354 2/20 0.35
NAPRT Q6XQN6 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
METAP2 P50579 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL31090281 0.78 PDE4A (0.45) PDE4APDE4CPDE4DADORA2AADORA1
SCHEMBL6512183 0.78 KDM4E (0.44) KDM4ELMNAP4HTMMETAP1BLM
SCHEMBL2141710 0.77 CCR1 (0.47) PDE4APDE4CPDE4DKDM4ELMNA
Biphenyl SCHEMBL28023256 0.77 PDE4A (0.42) PDE4APDE4CPDE4DKDM4EPTGS2
SCHEMBL29407474 0.76 PDE4A (0.40) PDE4APDE4CPDE4DPTGS2ADORA2A
SCHEMBL28022159 0.76 PDE4A (0.38) PDE4APDE4CPDE4DPTGS2CA1
SCHEMBL16872329 0.76 PDE4A (0.40) PDE4APDE4CPDE4DPTGS2ADORA2A
SCHEMBL30513347 0.76 PDE4A (0.38) PDE4APDE4CPDE4DPTGS2CA1
SCHEMBL2440826 0.76 PDE4A (0.39) PDE4APDE4CPDE4DMETAP1PTGS2
SCHEMBL1018963 0.76 PDE4A (0.41) PDE4APDE4CPDE4DADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119462520-A Preparation method of substituted benzoate derivative 上海皓元医药股份有限公司 2025-02-18 CN claimed
CN-114539247-A [1,2,4] triazolo [1,5-a ] pyridine compound and preparation method and application thereof 暨南大学 2022-05-27 CN claimed
US-12564636-B2 Pnictogen-containing heterocyclic compounds and their use UNIVERSITY OF RHODE ISLAND BOARD OF TRUSTEES (US) 2026-03-03 US disclosed
EP-4543446-A1 SUBSTITUTED FUSED BICYCLIC COMPOUNDS AND RELATED METHODS OF TREATMENT Alkermes, Inc. (US) 2025-04-30 EP disclosed
CN-119768169-A Substituted fused bicyclic compounds and related methods of treatment 阿尔克姆斯有限公司 2025-04-04 CN disclosed
WO-2025049976-A1 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF ONCOPIA THERAPEUTICS, INC. D/B/A SK LIFE SCIENCE LABS (US) 2025-03-06 WO disclosed
WO-2025049994-A1 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF ONCOPIA THERAPEUTICS, INC. D/B/A SK LIFE SCIENCE LABS (US) 2025-03-06 WO disclosed
CN-119462520-A Preparation method of substituted benzoate derivative 上海皓元医药股份有限公司 2025-02-18 CN disclosed
US-20240376044-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2024-11-14 US disclosed
US-20240285772-A1 PNICTOGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE COLGATE UNIVERSITY 2024-08-29 US disclosed
US-12071396-B2 Method for preparing aromatic amino acid derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-08-27 US disclosed
EP-0712493-A1 A METHOD FOR PREPARING AND SELECTING PHARMACEUTICALLY USEFUL NON-PEPTIDE COMPOUNDS FROM A STRUCTURALLY DIVERSE UNIVERSAL LIBRARY SPHINX PHARMACEUTICALS CORPORATION (US) 1996-05-22 EP disclosed
US-5480883-A Bis mono- and bicyclic aryl and heteroaryl compounds which inhibit EGF and/or PDGF receptor tyrosine kinase RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-01-02 US disclosed
WO-1995031438-A1 THERAPEUTIC PHENOXYALKYLHETEROCYCLES SANOFI WINTHROP, INC. (US) 1995-11-23 WO disclosed
US-5409930-A Inhibits abnoramal cell proliferation; dimethoxyquinoline/ dimethylquinoline/ quinolineoxide/ and quinoxaline derivatives RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-04-25 US disclosed
WO-1995004277-A1 A METHOD FOR PREPARING AND SELECTING PHARMACEUTICALLY USEFUL NON-PEPTIDE COMPOUNDS FROM A STRUCTURALLY DIVERSE UNIVERSAL LIBRARY SPHINX PHARMACEUTICALS CORPORATION (US) 1995-02-09 WO disclosed
WO-1993022285-A1 LEUKOTRIENE ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1993-11-11 WO disclosed
WO-1992020642-A1 BIS MONO-AND BICYCLIC ARYL AND HETEROARYL COMPOUNDS WHICH INHIBIT EGF AND/OR PDGF RECEPTOR TYROSINE KINASE RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-11-26 WO disclosed
CN-1042144-A Pesticidal compound ICI PLC (GB) 1990-05-16 CN disclosed
EP-0356029-A2 Insecticidal compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-02-28 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 (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-20240376044-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR PDE4A 4569/4885PDE4C 4664/4885PDE4D 4570/4885
US-12564636-B2 Pnictogen-containing heterocyclic compounds and their use CBR1, PNPO, NOX3 PDE4A 3892/4885PDE4C 3776/4885PDE4D 3994/4885
US-20240285772-A1 PNICTOGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE PYGL, UGT2B7, CYP2E1 PDE4A 3090/4885PDE4C 3136/4885PDE4D 3014/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR PDE4A 4569/4885PDE4C 4664/4885PDE4D 4570/4885

“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.