SCHEMBL10102175

SCHEMBL10102175

COCOC(c1ccc(C)c(OC(C)C)c1)C1CCC(CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CC1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SMYD2 Q9NRG4 2/20 0.34

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
SCHEMBL661651 0.91 CYP3A4 (0.35) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL10102177 0.76 SMYD2 (0.37) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL14042202 0.73 FFAR1 (0.33)
SCHEMBL661916 0.69 REN (0.32)
SCHEMBL30955759 0.67 SMYD2 (0.43) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL30726327 0.67 SMYD2 (0.43) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL30955729 0.67 SMYD2 (0.43) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL28917486 0.64 SMYD2 (0.43) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL31644559 0.64 SMYD2 (0.41) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL31216593 0.64 SMYD2 (0.41) CYP3A4HTTSMN1; SMN2SMYD2

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-8536157-B2 Non-steroidal compounds THE UNIVERSITY OF MELBOURNE (AU) 2013-09-17 US disclosed
US-20120046255-A1 NON-STEROIDAL COMPOUNDS THE UNIVERSITY OF MELBOURNE of ROYAL PARADE PARKVILLE (AU) 2012-02-23 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-20120046255-A1 NON-STEROIDAL COMPOUNDS PTGES2, PTGES, PTGES3 CYP3A4 500/4885HTT 3412/4885SMN1; SMN2 3060/4885

“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.