SCHEMBL11902232

SCHEMBL11902232

CC(C)CC1NCC(C(C)C)NC1=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PRCP P42785 1/20 0.32
PDE5A O76074 1/20 0.31
HTT P42858 1/20 0.31
PAX8 Q06710 1/20 0.31
GHSR Q92847 2/20 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
SCHEMBL11902505 1.00 GAA (0.35) GAALMNACYP3A4CYP2C9CYP2C19
SCHEMBL15235461 0.91 LMNA (0.31) GAALMNACYP3A4CYP2C9CYP2C19
SCHEMBL11902258 0.85 LMNA (0.33) GAALMNACYP3A4CYP2C9CYP2C19
SCHEMBL11902916 0.85 LMNA (0.33) GAALMNACYP3A4CYP2C9CYP2C19
SCHEMBL11902654 0.81 MEN1 (0.42) GAALMNACYP3A4CYP2C9CYP2C19
SCHEMBL11965155 0.80 MEN1 (0.33) GAALMNACYP3A4CYP2C9CYP2C19
SCHEMBL11902441 0.80 MEN1 (0.33) GAALMNACYP3A4CYP2C9CYP2C19
SCHEMBL11902442 0.80 MEN1 (0.33) GAALMNACYP3A4CYP2C9CYP2C19
SCHEMBL11902134 0.80 MEN1 (0.36) GAALMNACYP3A4CYP2C9CYP2C19
SCHEMBL11902192 0.80 MEN1 (0.36) GAALMNACYP3A4CYP2C9CYP2C19

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-20120202794-A1 COMPOUNDS PHARMASSET, INC. (US) 2012-08-09 US disclosed
WO-2012103113-A1 PYRAZINE AND IMIDAZOLIDINE DERIVATIVES AND THEIR USES TO TREAT HEPATITIS C GILEAD PHARMASSET, LLC (US) 2012-08-02 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 (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-20120202794-A1 COMPOUNDS HAVCR2, MAVS, GOT2 GAA 231/4885LMNA 4549/4885CYP3A4 408/4885

“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.