SCHEMBL2226469

SCHEMBL2226469

CC(C)(CCC#N)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ACLY P53396 1/20 0.42
ACACB O00763 1/20 0.41
ACACA Q13085 1/20 0.41
TBXAS1 P24557 3/20 0.35
TSHR P16473 3/20 0.34
PPARA Q07869 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
TTR P02766 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C8 P10632 1/20 0.34
CHRM1 P11229 1/20 0.34
CYP2C9 P11712 1/20 0.34
ADRA1A P35348 1/20 0.34
PPARG P37231 1/20 0.34
HTR2B P41595 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SLCO1B3 Q9NPD5 1/20 0.34
CISD1 Q9NZ45 1/20 0.34

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
SCHEMBL2278966 0.86 ACACB (0.52) MEN1KMT2AACLYACACBACACA
SCHEMBL4016071 0.83 MEN1 (0.45) MEN1KMT2ATSHRTDP1ALDH1A1
SCHEMBL9086970 0.81 MEN1 (0.44) MEN1KMT2ATDP1ALDH1A1
SCHEMBL14795068 0.81 MEN1 (0.44) MEN1KMT2ATDP1ALDH1A1SLC1A2
SCHEMBL9188074 0.77 MEN1 (0.46) MEN1KMT2ATSHR
SCHEMBL8961056 0.77 GGT1 (0.50) MEN1KMT2ATSHRTDP1CYP1A2
SCHEMBL3530150 0.76 ACLY (0.42) ACLYACACBACACATBXAS1TSHR
SCHEMBL320771 0.76 ACLY (0.54) ACLYACACBACACATBXAS1TSHR
SCHEMBL5789155 0.75
SCHEMBL1342649 0.75 MEN1 (0.52) MEN1KMT2ATDP1ALDH1A1SLC1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4695228-A1 SYNTHESIS OF RAS INHIBITORS Revolution Medicines, Inc. (US) 2026-02-18 EP disclosed
EP-4695233-A2 SYNTHESIS OF RAS INHIBITORS Revolution Medicines, Inc. (US) 2026-02-18 EP disclosed
US-20240383920-A1 SYNTHESIS OF RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2024-11-21 US disclosed
US-20240368190-A1 SYNTHESIS OF RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2024-11-07 US disclosed
WO-2024216008-A1 SYNTHESIS OF RAS INHIBITORS Revolution Medicines, Inc. (US) 2024-10-17 WO disclosed
WO-2024216017-A2 SYNTHESIS OF RAS INHIBITORS Revolution Medicines, Inc. (US) 2024-10-17 WO disclosed
US-8981084-B2 Oxadiazole HDAC inhibitors TEMPERO PHARMACEUTICALS, INC. (US) 2015-03-17 US disclosed
US-8981084-B2 Oxadiazole HDAC inhibitors TEMPERO PHARMACEUTICALS, INC. (US) 2015-03-17 US disclosed
US-20120322827-A1 COMPOUNDS AND METHODS TEMPERO PHARAMCEUTICALS. INC. 2012-12-20 US disclosed
EP-2523664-A1 COMPOUNDS AND METHODS Tempero Pharmaceuticals, Inc. (US) 2012-11-21 EP disclosed
EP-2523560-A1 COMPOUNDS AND METHODS Tempero Pharmaceuticals, Inc. (US) 2012-11-21 EP disclosed
US-20120289495-A1 COMPOUNDS AND METHODS Tempero Pharmaceuticals Inc. 2012-11-15 US disclosed
US-20120289495-A1 COMPOUNDS AND METHODS Tempero Pharmaceuticals Inc. 2012-11-15 US disclosed
WO-2011088187-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2011-07-21 WO disclosed
WO-2011088192-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2011-07-21 WO disclosed
WO-2011088187-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2011-07-21 WO disclosed
WO-2011088192-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2011-07-21 WO 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 (4 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-20240383920-A1 SYNTHESIS OF RAS INHIBITORS KRAS, NRAS, HRAS MEN1 530/4885KMT2A 2273/4885ACLY 2952/4885
US-20120322827-A1 COMPOUNDS AND METHODS XDH, LPXN, CCNY MEN1 625/4885KMT2A 2487/4885ACLY 136/4885
US-20240368190-A1 SYNTHESIS OF RAS INHIBITORS KRAS, NRAS, HRAS MEN1 530/4885KMT2A 2273/4885ACLY 2952/4885
US-20120289495-A1 COMPOUNDS AND METHODS XDH, CCNY, TOP2B MEN1 892/4885KMT2A 2762/4885ACLY 130/4885

“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.