SCHEMBL1893010

SCHEMBL1893010

CCOP(=O)(Nc1ccccc1)OCC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 1.00
KDM4E B2RXH2 5/20 0.57
LMNA P02545 3/20 0.54
HPGD P15428 3/20 0.54
HCRTR1 O43613 1/20 0.49
KCNH2 Q12809 1/20 0.48
HTT P42858 2/20 0.46
POLB P06746 1/20 0.46
ACHE P22303 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
NR1I2 O75469 1/20 0.44
XBP1 P17861 1/20 0.44
RECQL P46063 1/20 0.43

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
Ammonia Solution, Strong SCHEMBL9173134 0.98 NPSR1 (0.96) NPSR1KDM4ELMNAHPGDHCRTR1
SCHEMBL10885930 0.93 NPSR1 (0.86) NPSR1KDM4ELMNAHPGDHCRTR1
SCHEMBL9328075 0.86 NPSR1 (0.76) NPSR1KDM4ELMNAHPGDKCNH2
SCHEMBL9328047 0.85 NPSR1 (0.73) NPSR1KDM4ELMNAHPGDKCNH2
SCHEMBL9407022 0.85 NPSR1 (0.73) NPSR1KDM4ELMNAHPGDKCNH2
SCHEMBL29199368 0.84 NPSR1 (0.72) NPSR1KDM4ELMNAHPGDHCRTR1
SCHEMBL10192180 0.82 NPSR1 (0.69) NPSR1KDM4ELMNAHPGDHTT
SCHEMBL16868425 0.81 NPSR1 (0.68) NPSR1KDM4ELMNAHPGDKCNH2
SCHEMBL9328039 0.81 NPSR1 (0.68) NPSR1KDM4ELMNAHPGDKCNH2
SCHEMBL914682 0.80 NPSR1 (0.67) NPSR1KDM4ELMNAHPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113801254-B Polypropylene catalyst and preparation method thereof 中国石油天然气股份有限公司 2023-04-07 CN claimed
CN-113801254-A Polypropylene catalyst and preparation method thereof 中国石油天然气股份有限公司 2021-12-17 CN claimed
CN-113801254-B Polypropylene catalyst and preparation method thereof 中国石油天然气股份有限公司 2023-04-07 CN disclosed
CN-113801254-A Polypropylene catalyst and preparation method thereof 中国石油天然气股份有限公司 2021-12-17 CN disclosed
US-10927135-B2 Metal-free direct arylation of dialkyl phosphonates for the synthesis of mixed alkyl aryl phosphonates THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS (US) 2021-02-23 US disclosed
US-10927135-B2 Metal-free direct arylation of dialkyl phosphonates for the synthesis of mixed alkyl aryl phosphonates THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS (US) 2021-02-23 US disclosed
US-20200255461-A1 METAL-FREE DIRECT ARYLATION OF DIALKYL PHOSPHONATES FOR THE SYNTHESIS OF MIXED ALKYL ARYL PHOSPHONATES THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS 2020-08-13 US disclosed
US-20200255461-A1 METAL-FREE DIRECT ARYLATION OF DIALKYL PHOSPHONATES FOR THE SYNTHESIS OF MIXED ALKYL ARYL PHOSPHONATES THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS 2020-08-13 US disclosed
WO-2019028391-A1 METAL-FREE DIRECT ARYLATION OF DIALKYL PHOSPHONATES FOR THE SYNTHESIS OF MIXED ALKYL ARYL PHOSPHONATES THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS (US) 2019-02-07 WO disclosed
US-20110114901-A1 Cellulose Acetate Film SK ENERGY CO., LTD. (KR) 2011-05-19 US disclosed
US-20110114901-A1 Cellulose Acetate Film SK ENERGY CO., LTD. (KR) 2011-05-19 US disclosed
US-20110114901-A1 Cellulose Acetate Film SK ENERGY CO., LTD. (KR) 2011-05-19 US disclosed
WO-2010005241-A2 CELLULOSE ACETATE FILM SK ENERGY CO., LTD. (KR) 2010-01-14 WO disclosed
US-5189023-A Hypotensive agent AMERICAN CYANAMID COMPANY (US) 1993-02-23 US 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-20200255461-A1 METAL-FREE DIRECT ARYLATION OF DIALKYL PHOSPHONATES FOR THE SYNTHESIS OF MIXED ALKYL ARYL PHOSPHONATES SLC35B2, PPIP5K2, PPA1 NPSR1 989/4885KDM4E 2030/4885LMNA 4753/4885
US-10927135-B2 Metal-free direct arylation of dialkyl phosphonates for the synthesis of mixed alkyl aryl phosphonates SLC35B2, PPIP5K2, PPA1 NPSR1 989/4885KDM4E 2030/4885LMNA 4753/4885

“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.