SCHEMBL13626229

SCHEMBL13626229

CC(C)C[C@@H]1COOC(=O)N1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PLG P00747 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
GAA P10253 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CDC7 O00311 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
SCHEMBL14832425 0.81 KMT2A (0.35) MEN1KMT2APLGLMNACYP3A4
SCHEMBL12161361 0.81 KMT2A (0.35) MEN1KMT2APLGLMNACYP3A4
SCHEMBL14553365 0.81 KMT2A (0.35) MEN1KMT2APLGLMNACYP3A4
SCHEMBL19442208 0.70 PLG (0.35) MEN1KMT2APLGLMNACYP3A4
SCHEMBL1004978 0.70 MEN1 (0.36) MEN1KMT2APLGLMNACYP3A4
SCHEMBL12148580 0.67
SCHEMBL13626225 0.67 MIF (0.30)
SCHEMBL25253638 0.63 IRAK4 (0.35) KMT2A
SCHEMBL27367158 0.63 IRAK4 (0.32) KMT2A
SCHEMBL6961435 0.63 PLG (0.35) PLGCDC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090286938-A1 SYNTHESIS OF HYBRID BLOCK COPOLYMERS FROM DIFLUOROACETATE AMMONIUM SALTS INTEZYNE TECHNOLOGIES, INC. (US) 2009-11-19 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-20090286938-A1 SYNTHESIS OF HYBRID BLOCK COPOLYMERS FROM DIFLUOROACETATE AMMONIUM SALTS PFAS, GFPT1, PFKFB4 MEN1 2965/4885KMT2A 1393/4885PLG 4042/4885

“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.