SCHEMBL764174

SCHEMBL764174

CC(CCC(=O)O)C(=O)OC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.54
GABRP O00591 2/20 0.43
GABRD O14764 2/20 0.43
GABRA1 P14867 2/20 0.43
GABRB1 P18505 2/20 0.43
GABRG2 P18507 2/20 0.43
GABRB3 P28472 2/20 0.43
GABRA5 P31644 2/20 0.43
GABRA3 P34903 2/20 0.43
GABRA2 P47869 2/20 0.43
GABRB2 P47870 2/20 0.43
GABRA4 P48169 2/20 0.43
GABRE P78334 2/20 0.43
GABRA6 Q16445 2/20 0.43
GABRG1 Q8N1C3 2/20 0.43
GABRG3 Q99928 2/20 0.43
GABRQ Q9UN88 2/20 0.43
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL27416805 1.00 CYP1A2 (0.54) CYP1A2GABRPGABRDGABRA1GABRB1
SCHEMBL11420328 1.00 CYP1A2 (0.54) CYP1A2GABRPGABRDGABRA1GABRB1
SCHEMBL27533855 0.85 CYP1A2 (0.42) CYP1A2GABRPGABRDGABRA1GABRB1
SCHEMBL31364339 0.85 FFAR4 (0.47) MEN1KMT2ATSHRNFKB1
SCHEMBL16660376 0.84 CYP2D6 (0.37) CYP1A2MEN1KMT2AGAANOS1
SCHEMBL15984252 0.84 CYP2D6 (0.37) CYP1A2MEN1KMT2AGAANOS1
SCHEMBL15373759 0.82 NOS1 (0.35) CYP1A2MEN1KMT2AGAANOS1
SCHEMBL28276395 0.82 FOLH1 (0.41) CYP1A2GABRPGABRDGABRA1GABRB1
SCHEMBL28718237 0.81 KMT2A (0.39) MEN1KMT2AGAANOS1NOS3
SCHEMBL14593930 0.81 KMT2A (0.39) MEN1KMT2AGAANOS1NOS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230366885-A1 DNA CONSTRUCTS, RECOMBINANT CELLS COMPRISING THEREOF, BACTERIAL PROBES, METHODS FOR THEIR PREPARATION, AND METHOD OF USING THEREOF YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-11-16 US disclosed
US-20230151360-A1 NUCLEIC ACID COMPLEX AND PHARMACEUTICAL COMPOSITION CONTAINING SAME EISAI R&D MANAGEMENT CO., LTD. (JP) 2023-05-18 US disclosed
US-8138145-B2 Hybrid oligomers, their preparation process and pharmaceutical compositions containing them Centre National de la Recherche Scientifique (SNRS) (FR) 2012-03-20 US disclosed
US-20100298206-A1 HYBRID OLIGOMERS, THEIR PREPARATION PROCESS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS), I.B.M.C. (FR) 2010-11-25 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-20100298206-A1 HYBRID OLIGOMERS, THEIR PREPARATION PROCESS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM NOD2, NOD1, COG5 CYP1A2 3686/4885GABRP 1004/4885GABRD 2727/4885
US-20230151360-A1 NUCLEIC ACID COMPLEX AND PHARMACEUTICAL COMPOSITION CONTAINING SAME SNRPA, NSUN2, NSUN3 CYP1A2 4708/4885GABRP 2510/4885GABRD 2587/4885

“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.