SCHEMBL20133824

SCHEMBL20133824

BN(CC)C(=O)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CNR2 P34972 1/20 0.31

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
SCHEMBL678573 0.72 LMNA (0.42) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL28461943 0.72 MEN1 (0.35) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL11996521 0.70 RIPK1 (0.39) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL5417010 0.70 LMNA (0.36) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL17333379 0.68 MEN1 (0.33) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL12245562 0.68 MEN1 (0.33) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL22957879 0.67 MEN1 (0.31) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL14544847 0.67 CHRM2 (0.40) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL13678599 0.67 MEN1 (0.32) MEN1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL13994290 0.65 MEN1 (0.31) MEN1CYP3A4CYP2C9CYP2C19KMT2A

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-20180125848-A1 PREPARATION AND METHODS OF USE FOR ORTHO-ARYL 5-MEMBERED HETEROARYL-CARBOXAMIDE CONTAINING MULTI-TARGETED KINASE INHIBITORS VIBLIOME THERAPEUTICS, LLC 2018-05-10 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-20180125848-A1 PREPARATION AND METHODS OF USE FOR ORTHO-ARYL 5-MEMBERED HETEROARYL-CARBOXAMIDE CONTAINING MULTI-TARGETED KINASE INHIBITORS ABL1, ERBB2, MAP3K2 MEN1 2114/4885CYP3A4 2553/4885CYP2C9 1674/4885

“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.