SCHEMBL13250486

SCHEMBL13250486

CC1CC(O[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)C1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.36
▸ LMNA P02545 2/20 0.31
▸ NR1I2 O75469 1/20 0.31
▸ ABCB11 O95342 1/20 0.31
▸ SMYD2 Q9NRG4 2/20 0.31
▸ CYP3A4 P08684 2/20 0.31
▸ HTT P42858 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 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
SCHEMBL25520998 1.00 BACE1 (0.36) BACE1LMNANR1I2ABCB11SMYD2
SCHEMBL1139919 0.85 BACE1 (0.36) BACE1SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL17522170 0.85 KDM1A (0.36) BACE1LMNASMYD2CYP3A4HTT
SCHEMBL1560459 0.85 BACE1 (0.36) BACE1SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL25208294 0.85 BACE1 (0.36) BACE1SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL25417788 0.85 BACE1 (0.36) BACE1SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL1139920 0.85 BACE1 (0.36) BACE1SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL17808583 0.85 BACE1 (0.36) BACE1SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL22283784 0.85 BACE1 (0.36) BACE1SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL31035756 0.85 BACE1 (0.36) BACE1LMNASMYD2CYP3A4HTT

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-20100190687-A1 PYRIMIDINONE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION 2010-07-29 — — 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-20100190687-A1 PYRIMIDINONE DERIVATIVES AND METHODS OF USE THEREOF GPR119, GCGR, GPR65 BACE1 2379/4885LMNA 3496/4885NR1I2 508/4885

“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.

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