SCHEMBL851491

SCHEMBL851491

O=C(c1ccc(Cl)cc1)c1ccc(I)cc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.64
MAPK1 P28482 1/20 0.64
HPGD P15428 1/20 0.55
CES2 O00748 2/20 0.54
CES1 P23141 2/20 0.54
ALOX15 P16050 1/20 0.52
TSHR P16473 1/20 0.52
TPMT P51580 1/20 0.52
CA1 P00915 4/20 0.50
CA2 P00918 4/20 0.50
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
NR4A1 P22736 1/20 0.48
MGLL Q99685 1/20 0.47
VNN1 O95497 1/20 0.47
ELANE P08246 1/20 0.47
GSK3B P49841 1/20 0.46

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
SCHEMBL10697158 0.87 SRD5A2 (0.80) SRD5A2MAPK1HPGDCES2CES1
SCHEMBL1681512 0.87 SRD5A2 (0.80) SRD5A2MAPK1HPGDCES2CES1
SCHEMBL9065412 0.87 SRD5A2 (0.80) SRD5A2MAPK1HPGDCES2CES1
SCHEMBL51827 0.87 SRD5A2 (0.80) SRD5A2MAPK1HPGDCES2CES1
SCHEMBL3841301 0.87 TPMT (0.65) SRD5A2MAPK1HPGDTPMTCA1
SCHEMBL1244094 0.87 TPMT (0.65) SRD5A2MAPK1HPGDTPMTCA1
SCHEMBL9389844 0.87 TPMT (0.65) SRD5A2MAPK1HPGDTPMTCA1
Hydrochloric Acid SCHEMBL11704986 0.85 SRD5A2 (0.76) SRD5A2MAPK1HPGDCES2CES1
SCHEMBL30010720 0.85 SRD5A2 (0.76) SRD5A2MAPK1HPGDCES2CES1
SCHEMBL29985694 0.85 SRD5A2 (0.76) SRD5A2MAPK1HPGDCES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117769458-A Method for preparing a medium of a substantially monodisperse population of polyarylene ketone or polyarylene sulfide ketone particles, and container comprising said medium 安捷伦科技有限公司 2024-03-26 CN disclosed
CN-117693551-A Method for preparing porous devices from monodisperse populations of poly aryl ketone or poly aryl thioether ketone particles 安捷伦科技有限公司 2024-03-12 CN disclosed
CN-117693542-A Method for preparing monodisperse populations of poly aryl ketone or poly aryl thioether ketone particles 安捷伦科技有限公司 2024-03-12 CN disclosed
US-20230052045-A1 METHODS OF MAKING POROUS DEVICES FROM MONODISPERSE POPULATIONS OF POLYARYLKETONE OR POLYARYLTHIOETHERKETONE PARTICLES AGILENT TECHNOLOGIES, INC. (US) 2023-02-16 US disclosed
US-20230051959-A1 METHODS OF MAKING MONODISPERSE POPULATIONS OF POLYARYLKETONE OR POLYARYLTHIOETHERKETONE PARTICLES AGILENT TECHNOLOGIES, INC. (US) 2023-02-16 US disclosed
US-20230047460-A1 METHODS OF MAKING MEDIA OF SUBSTANTIALLY MONODISPERSE POPULATIONS OF POLYARYLKETONE OR POLYARYLTHIOETHERKETONE PARTICLES, AND CONTAINERS COMPRISING THEM AGILENT TECHNOLOGIES, INC. (US) 2023-02-16 US disclosed
WO-2023009879-A1 METHODS OF MAKING POROUS DEVICES FROM MONODISPERSE POPULATIONS OF POLYARYLKETONE OR POLYARYLTHIOETHERKETONE PARTICLES AGILENT TECHNOLOGIES, INC. (US) 2023-02-02 WO disclosed
WO-2023009878-A1 METHODS OF MAKING MONODISPERSE POPULATIONS OF POLYARYLKETONE OR POLYARYLTHIOETHERKETONE PARTICLES AGILENT TECHNOLOGIES, INC. (US) 2023-02-02 WO disclosed
WO-2023009880-A1 METHODS OF MAKING MEDIA OF SUBSTANTIALLY MONODISPERSE POPULATIONS OF POLYARYLKETONE OR POLYARYLTHIOETHERKETONE PARTICLES, AND CONTAINERS COMPRISING THEM AGILENT TECHNOLOGIES, INC. (US) 2023-02-02 WO disclosed
EP-2937374-B1 METHOD FOR PRODUCING CYCLIC POLYPHENYLENE ETHER ETHER KETONE COMPOSITION AND LINEAR POLYPHENYLENE ETHER ETHER KETONE, AND METHOD FOR PRODUCING POLYPHENYLENE ETHER ETHER KETONE TORAY INDUSTRIES (JP) 2018-06-27 EP disclosed
EP-1902032-A1 PHARMACEUTICAL COMPOUNDS Astex Therapeutics Limited (GB) 2008-03-26 EP disclosed
CN-1922148-A Pyrazole derivatives as protein kinase modulators ASTEX THERAPEUTICS LTD (GB) 2007-02-28 CN disclosed
WO-2006136830-A1 ARYL-ALKYLAMINES AND HETEROARYL-ALKYLAMINES AS PROTEIN KINASE INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2006-12-28 WO disclosed
WO-2006136821-A1 PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2006-12-28 WO disclosed
WO-2006136837-A2 PHARMACEUTICAL COMBINATIONS COMPRISING PYRAZOLE DERIVATIVES AS PROTEIN KINASE MODULATORS ASTEX THERAPEUTICS LIMITED (GB) 2006-12-28 WO disclosed
EP-1706385-A1 PYRAZOLE DERIVATIVES AS PROTEIN KINASE MODULATORS Astex Therapeutics Limited (GB) 2006-10-04 EP disclosed
WO-2005061463-A1 PYRAZOLE DERIVATIVES AS PROTEIN KINASE MODULATORS ASTEX THERAPEUTICS LIMITED (GB) 2005-07-07 WO disclosed
US-6034206-A POLYANILINES; HEAT, CHEMICAL AND SOLVENT RESISTANCE TOSOH CORPORATION (JP) 2000-03-07 US disclosed
US-5208259-A Lipoxygenase enzyme inhibitors IMPERIAL CHEMICAL INDUSTRIES (GB) 1993-05-04 US disclosed
EP-0409413-A2 Diaryl ether heterocycles IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-01-23 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 (1 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-20230047460-A1 METHODS OF MAKING MEDIA OF SUBSTANTIALLY MONODISPERSE POPULATIONS OF POLYARYLKETONE OR POLYARYLTHIOETHERKETONE PARTICLES, AND CONTAINERS COMPRISING THEM TKT, FAH, BCKDK SRD5A2 1601/4885MAPK1 4111/4885HPGD 1786/4885

“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.