SCHEMBL765917

SCHEMBL765917

CCC(CO)(CO)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.35
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.30
CYP2C19 P33261 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL20224768 0.94 DPP4 (0.35) DPP4TSHRALDH1A1CYP2C19TDP1
SCHEMBL6913846 0.83 DPP4 (0.40) DPP4TSHRALDH1A1CYP2C19TDP1
Methacrylic Acid SCHEMBL8850801 0.80 TGFBR1 (0.32) TSHRALDH1A1TDP1
SCHEMBL27495868 0.80
SCHEMBL18124696 0.80 ALDH1A1 (0.32) TSHRALDH1A1
SCHEMBL9713104 0.79 TSHR (0.33) TSHRTDP1
SCHEMBL228973 0.79 TSHR (0.35) DPP4TSHRALDH1A1TDP1
SCHEMBL9522456 0.79 TSHR (0.35) DPP4TSHRALDH1A1TDP1
SCHEMBL1614870 0.77 TSHR (0.33) DPP4TSHR
SCHEMBL349071 0.77 DPP4 (0.32) DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1219953-A Fabric softening compound/composition PROCTER & GAMBLE (US) 1999-06-16 CN claimed
CN-1195369-A Concentrated and stable fabric softening compositions PROCTER & GAMBLE (US) 1998-10-07 CN claimed
US-11780835-B2 Pyrazolo[3,4-b]pyridine compounds as inhibitors of TAM and MET kinases ARRAY BIOPHARMA INC. (US) 2023-10-10 US disclosed
WO-2022270583-A1 RESIN COMPOSITION, MOLDED ARTICLE, LAMINATE FILM, AND PACKAGING CONTAINER 藤森工業株式会社 2022-12-29 WO disclosed
CN-115043895-A PNU-159682 and preparation method of intermediate thereof 戊言医药科技(上海)有限公司 2022-09-13 CN disclosed
US-20170260192-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPT OF HEALTH AND HUMAN SERVICES (US) 2017-09-14 US disclosed
US-20170107202-A1 COMPOUNDS USEFUL AS IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY 2017-04-20 US disclosed
WO-2016191172-A1 QUINOLONE DERIVATIVES AS FIBROBLAST GROWTH FACTOR RECEPTOR INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2016-12-01 WO disclosed
US-20140323438-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS NORTHWESTERN UNIVERSITY 2014-10-30 US disclosed
US-8642576-B2 Heterocyclic CETP inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-02-04 US disclosed
US-20120322761-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-12-20 US disclosed
US-5663264-A OF A COPOLYMER CONTAINING AN ALKYLENE OXIDE MONOMER, A POLYFUNCTIONAL (METH)ACRYLATE MONOMER AND A VINYL MONOMER HITACHI CHEMICAL COMPANY, LTD. (JP) 1997-09-02 US disclosed
WO-1997003172-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITIONS INCLUDING CHELANTS THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO disclosed
US-5583191-A FORMED OF TRANSPARENT RESIN OBTAINED BY POLYMERIZING MONOMER HAVING ALKYLENE OXIDE GROUP, POLYFUNCTIONAL (METH)ACRYLATE HAVING DIVALENT BRANCED HYDROCARBON GROUP, OPTIONAL ADDITIONAL VINYL MONOMER; HEAT RESISTANCE HITACHI CHEMICAL COMPANY, LTD. (JP) 1996-12-10 US disclosed
EP-0379190-B1 A polyester laminated film TOYO BOSEKI (JP) 1996-08-14 EP disclosed
EP-0712719-A1 A polyester laminated film Toyo Boseki Kabushiki Kaisha (JP) 1996-05-22 EP disclosed
US-5458965-A Heat-sealing; blends; for wrapping TOYO BOSEKI KABUSHIKI KAISHA (JP) 1995-10-17 US disclosed
EP-0661307-A2 Transparent resin and plastic lens HITACHI CHEMICAL CO., LTD. (JP) 1995-07-05 EP disclosed
EP-0405271-A1 Process for the production 1,3-dioxolane and 1,3-dioxane derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1991-01-02 EP disclosed
EP-0379190-A2 A polyester laminated film Toyo Boseki Kabushiki Kaisha (JP) 1990-07-25 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 (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-20140323438-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS PGF, BRCA1, RB1 DPP4 2831/4885TSHR 2873/4885ALDH1A1 192/4885
US-20170260192-A1 COMPOUNDS AND METHODS FOR THE PREVENTION AND TREATMENT OF TUMOR METASTASIS AND TUMORIGENESIS PGF, BRCA1, RB1 DPP4 2831/4885TSHR 2873/4885ALDH1A1 192/4885
US-20120322761-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 DPP4 2003/4885TSHR 2250/4885ALDH1A1 2353/4885
US-20170107202-A1 COMPOUNDS USEFUL AS IMMUNOMODULATORS CD74, HLA-DRB1, CD47 DPP4 2337/4885TSHR 3660/4885ALDH1A1 1130/4885
US-11780835-B2 Pyrazolo[3,4-b]pyridine compounds as inhibitors of TAM and MET kinases RET, MERTK, MET DPP4 1555/4885TSHR 526/4885ALDH1A1 2121/4885

“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.