SCHEMBL890074

SCHEMBL890074

CCC1COCCN1CC

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 4/20 0.39
PDK2 Q15119 1/20 0.38
PDK3 Q15120 1/20 0.38
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
PIK3CA P42336 1/20 0.30
MTOR P42345 1/20 0.30
GAA P10253 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
SCHEMBL25125561 1.00 PDK1 (0.39) PDK1PDK2PDK3CA12CA1
Hydrochloric Acid SCHEMBL31393754 0.96 PDK1 (0.37) PDK1PDK2PDK3CA12CA1
SCHEMBL9801150 0.83 PDK1 (0.37) PDK1PDK2PDK3GAA
SCHEMBL772683 0.83 PDK1 (0.37) PDK1PDK2PDK3
SCHEMBL17778486 0.83 PDK1 (0.51) PDK1PDK2PDK3CA12CA1
SCHEMBL1700062 0.83 PDK1 (0.51) PDK1PDK2PDK3CA12CA1
SCHEMBL24630698 0.83 PDK1 (0.51) PDK1PDK2PDK3CA12CA1
SCHEMBL1806182 0.83 PDK1 (0.37) PDK1PDK2PDK3CA12CA1
SCHEMBL24624661 0.80 PDK1 (0.36) PDK1PDK2PDK3PIK3CAMTOR
SCHEMBL18483388 0.80 PDK1 (0.55) PDK1PDK2PDK3MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112479459-B Preparation method of preferential water permeable membrane, morpholine wastewater treatment method and morpholine substance recovery method 万华化学集团股份有限公司 2023-01-17 CN claimed
CN-112479459-A Preparation method of preferential water permeable membrane, morpholine wastewater treatment method and morpholine substance recovery method 万华化学集团股份有限公司 2021-03-12 CN claimed
EP-2197933-B1 AMINE CATALYSTS FOR POLYURETHANE FOAMS HONEYWELL INT INC (US) 2025-07-16 EP disclosed
US-20250154162-A1 COMPOUND FOR REGULATING AND CONTROLLING 15-PGDH ACTIVITY AND PREPARATION METHOD THEREFOR SCINNOHUB PHARMACEUTICAL CO., LTD. (CN) 2025-05-15 US disclosed
EP-4446310-A1 METHOD FOR PRODUCING BLOCKED ISOCYANATE COMPOUND AND METHOD FOR PRODUCING ISOCYANATE COMPOUND Asahi Kasei Kabushiki Kaisha (JP) 2024-10-16 EP disclosed
CN-118591545-A Compound for regulating 15-PGDH activity and preparation method thereof 赛诺哈勃药业(成都)有限公司 2024-09-03 CN disclosed
US-12054472-B2 1,2,4-triazine-4-amine derivatives NXERA PHARMA UK LIMITED (GB) 2024-08-06 US disclosed
CN-118382612-A Method for producing blocked isocyanate compound and method for producing isocyanate compound 旭化成株式会社 2024-07-23 CN disclosed
WO-2024063100-A1 METHOD FOR PRODUCING POLYVALENT CARBODIIMIDE B 旭化成株式会社 2024-03-28 WO disclosed
WO-2023143432-A1 COMPOUND FOR REGULATING AND CONTROLLING 15-PGDH ACTIVITY AND PREPARATION METHOD THEREFOR 赛诺哈勃药业(成都)有限公司 2023-08-03 WO disclosed
WO-2023106377-A1 METHOD FOR PRODUCING BLOCKED ISOCYANATE COMPOUND AND METHOD FOR PRODUCING ISOCYANATE COMPOUND 旭化成株式会社 2023-06-15 WO disclosed
US-20100234364-A1 CCR2 INHIBITORS AND METHODS OF USE THEREOF CHEMOCENTRYX, INC. 2010-09-16 US disclosed
US-20100160287-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-06-24 US disclosed
EP-1869054-A2 CONDENSED ISOXALINE DERIVATIVES AS INHIBITORS OF PHOSPHODIESTERASE TYPE-IV Ranbaxy Laboratories Limited (IN) 2007-12-26 EP disclosed
US-20070203142-A1 for treating proliferative disorders, cardiac disorders, neurodegenerative disorders, autoimmune disorders, conditions associated with organ transplantation, inflammatory disorders, and/or immunologically mediated disorders VERTEX PHARMACEUTICALS INCORPORATED 2007-08-30 US disclosed
WO-2006085212-A2 CONDENSED ISOXALINE DERIVATIVES AS INHIBITORS OF PHOSPHODIESTERASE TYPE-IV RANBAXY LABORATORIES LIMITED (IN) 2006-08-17 WO disclosed
EP-0789062-B1 WATER-ABSORBENT RESIN DISPERSION AND POLYURETHANE COMPOSITION SANYO CHEMICAL IND LTD (JP) 2003-01-22 EP disclosed
US-5994421-A CROSSLINKING SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-30 US disclosed
EP-0789062-A1 WATER-ABSORBENT RESIN DISPERSION AND POLYURETHANE COMPOSITION SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1997-08-13 EP disclosed
US-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 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 (5 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-20070203142-A1 for treating proliferative disorders, cardiac disorders, neurodegenerative disorders, autoimmune disorders, conditions associated with organ transplantation, inflammatory disorders, and/or immunologically mediated disorders JAK1, JAK3, MYLK2 PDK1 286/4885PDK2 491/4885PDK3 364/4885
US-20100234364-A1 CCR2 INHIBITORS AND METHODS OF USE THEREOF CCR2, CCR9, CCR1 PDK1 3777/4885PDK2 2433/4885PDK3 3371/4885
US-20250154162-A1 COMPOUND FOR REGULATING AND CONTROLLING 15-PGDH ACTIVITY AND PREPARATION METHOD THEREFOR CYP51A1, HPGD, HSD11B1 PDK1 184/4885PDK2 189/4885PDK3 269/4885
US-12054472-B2 1,2,4-triazine-4-amine derivatives ADORA2A, ADORA2B, ADORA1 PDK1 2305/4885PDK2 1125/4885PDK3 2412/4885
US-20100160287-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES JAK2, JAK1, JAK3 PDK1 323/4885PDK2 554/4885PDK3 648/4885

“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.