SCHEMBL8570280

SCHEMBL8570280

CC(C)N(C)C(=O)C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
DPP4 P27487 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
MEN1 O00255 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 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
Acetonitrile SCHEMBL11503668 0.89 DPP4 (0.39) DPP4CHRM2CHRM4CHRM5CHRM1
SCHEMBL23086044 0.79 DPP4 (0.34) DPP4CHRM2CHRM4CHRM5CHRM1
SCHEMBL23872426 0.79 DPP4 (0.34) DPP4
SCHEMBL23872424 0.79 DPP4 (0.34) DPP4
SCHEMBL6656541 0.79 POLB (0.32) POLBDPP4
SCHEMBL28539062 0.79 POLB (0.32) POLBDPP4
SCHEMBL23869968 0.77 POLB (0.31) POLB
SCHEMBL26700648 0.77 POLB (0.31) POLB
SCHEMBL14519699 0.77 TP53 (0.33) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL18336693 0.77 TP53 (0.33) MEN1CYP3A4CYP2C9CYP2C19KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2024-07-16 US disclosed
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2024-07-16 US disclosed
CN-111051432-B Resin composition, method for producing resin film, and method for producing electronic device 东丽株式会社 2023-04-04 CN disclosed
US-20220402907-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE YALE UNIVERSITY 2022-12-22 US disclosed
US-11352342-B2 Pharmaceutical compounds HEPTARES THERAPEUTICS LIMITED (GB) 2022-06-07 US disclosed
US-11319312-B2 Pharmaceutical compounds HEPTARES THERAPEUTICS LIMITED 2022-05-03 US disclosed
US-11161841-B2 Modulators of proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2021-11-02 US disclosed
US-20210101893-A1 PHARMACEUTICAL COMPOUNDS NXERA PHARMA UK LIMITED (GB) 2021-04-08 US disclosed
US-10941158-B2 Pyrazole ACC inhibitors and uses thereof GILEAD APOLLO, LLC (US) 2021-03-09 US disclosed
US-20210040067-A1 PHARMACEUTICAL COMPOUNDS NXERA PHARMA UK LIMITED (GB) 2021-02-11 US disclosed
US-8026368-B2 Hydrazide compounds and thrombopoietin receptor activators NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-09-27 US disclosed
US-20110190227-A1 Antagonists of Prostaglandin D2 Receptors AMIRA PHARMACEUTICALS, INC. (US) 2011-08-04 US disclosed
US-7897601-B2 Cannabinoid receptor modulators INTERVET, INC. (US) 2011-03-01 US disclosed
US-7897601-B2 Cannabinoid receptor modulators INTERVET, INC. (US) 2011-03-01 US disclosed
US-20090253751-A1 HYDRAZIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-10-08 US disclosed
US-20090253751-A1 HYDRAZIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-10-08 US disclosed
US-20070197628-A1 Cannabinoid receptor modulators INTERVET INTERNATIONAL B.V. (NL) 2007-08-23 US disclosed
US-20070197628-A1 Cannabinoid receptor modulators INTERVET INTERNATIONAL B.V. (NL) 2007-08-23 US disclosed
US-7176205-B2 Bi-pyridinyl derivatives as NK-1 antagonists HOFFMANN-LA ROCHE INC. (US) 2007-02-13 US disclosed
US-5846990-A Substituted biphenyl isoxazole sulfonamides BRISTOL-MYERS SQUIBB CO. (US) 1998-12-08 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 (11 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-20210040067-A1 PHARMACEUTICAL COMPOUNDS CHRM1, CHRM2, CHRM4 POLB 4054/4885DPP4 1158/4885CHRM2 2/4885
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 POLB 4196/4885DPP4 2499/4885CHRM2 4721/4885
US-11319312-B2 Pharmaceutical compounds CHRM1, CHRM2, CHRM4 POLB 4039/4885DPP4 769/4885CHRM2 2/4885
US-11352342-B2 Pharmaceutical compounds CHRM1, CHRM2, CHRM4 POLB 4054/4885DPP4 1158/4885CHRM2 2/4885
US-20070197628-A1 Cannabinoid receptor modulators CNR1, CNR2, GPR18 POLB 3689/4885DPP4 2266/4885CHRM2 592/4885
US-20220402907-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE MDM2, CRBN, VHL POLB 2694/4885DPP4 3801/4885CHRM2 4359/4885
US-20090253751-A1 HYDRAZIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR TEK, THPO, PTAFR POLB 3909/4885DPP4 1295/4885CHRM2 984/4885
US-20110190227-A1 Antagonists of Prostaglandin D2 Receptors PTGDR, PTGDR2, PTGER2 POLB 3070/4885DPP4 2139/4885CHRM2 490/4885
US-11161841-B2 Modulators of proteolysis and associated methods of use MDM2, CRBN, VHL POLB 2694/4885DPP4 3801/4885CHRM2 4359/4885
US-10941158-B2 Pyrazole ACC inhibitors and uses thereof ACACA, ACACB, PC POLB 1536/4885DPP4 829/4885CHRM2 4608/4885
US-20210101893-A1 PHARMACEUTICAL COMPOUNDS CHRM1, CHRM2, CHRM4 POLB 4039/4885DPP4 769/4885CHRM2 2/4885

“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.