SCHEMBL29318676

SCHEMBL29318676

CCOC(=O)/C=C/CC1CN(C(=O)OC(C)(C)C)CCO1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RECQL P46063 2/20 0.38
PDK1 Q15118 3/20 0.36
TSHR P16473 1/20 0.36
EPHA2 P29317 4/20 0.35
NR1H2 P55055 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
ERBB2 P04626 1/20 0.34
EPHB4 P54760 1/20 0.34
P2RX3 P56373 3/20 0.33
P2RX2 Q9UBL9 3/20 0.33

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
SCHEMBL18259388 0.89 USP2 (0.39) USP2SMN1; SMN2RECQLPDK1TSHR
SCHEMBL18259389 0.89 USP2 (0.39) USP2SMN1; SMN2RECQLPDK1TSHR
SCHEMBL18259390 0.89 USP2 (0.39) USP2SMN1; SMN2RECQLPDK1TSHR
SCHEMBL22010255 0.89 USP2 (0.39) USP2SMN1; SMN2RECQLPDK1TSHR
SCHEMBL23890968 0.82 USP2 (0.46) USP2SMN1; SMN2RECQLPDK1EPHA2
SCHEMBL18259315 0.81 SMN1; SMN2 (0.43) USP2SMN1; SMN2RECQLTSHRNR1H2
SCHEMBL18259317 0.81 SMN1; SMN2 (0.43) USP2SMN1; SMN2RECQLTSHRNR1H2
SCHEMBL23764590 0.81 SMN1; SMN2 (0.43) USP2SMN1; SMN2RECQLTSHRNR1H2
SCHEMBL18689037 0.81 SMN1; SMN2 (0.43) USP2SMN1; SMN2RECQLTSHRNR1H2
SCHEMBL18259316 0.81 SMN1; SMN2 (0.43) USP2SMN1; SMN2RECQLTSHRNR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239756-A1 NOVEL 3, 5-DISUBSTITUTED PYRIDINE AND 3, 5-DISUBSTITUTED PYRIDAZINE DERIVATIVES AND PHARMACEUTICAL USE OF SAME MITSUBISHI TANABE PHARMA CORPORATION (JP) 2024-07-18 US disclosed
US-20240239756-A1 NOVEL 3, 5-DISUBSTITUTED PYRIDINE AND 3, 5-DISUBSTITUTED PYRIDAZINE DERIVATIVES AND PHARMACEUTICAL USE OF SAME MITSUBISHI TANABE PHARMA CORPORATION (JP) 2024-07-18 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 (1 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-20240239756-A1 NOVEL 3, 5-DISUBSTITUTED PYRIDINE AND 3, 5-DISUBSTITUTED PYRIDAZINE DERIVATIVES AND PHARMACEUTICAL USE OF SAME ENPP2, SSB, PLPBP USP2 1786/4885SMN1; SMN2 2393/4885RECQL 506/4885

“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.