SCHEMBL8940570

SCHEMBL8940570

C=C(C)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 3/20 0.36
GPR174 Q9BXC1 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
CYP3A4 P08684 1/20 0.33
HTT P42858 1/20 0.33
MEN1 O00255 4/20 0.31
KMT2A Q03164 4/20 0.31
MAPT P10636 3/20 0.31
NPSR1 Q6W5P4 2/20 0.31
LMNA P02545 1/20 0.31
ALOX12 P18054 1/20 0.31
KDM4E B2RXH2 1/20 0.30
USP2 O75604 1/20 0.30
TP53 P04637 1/20 0.30
POLB P06746 1/20 0.30
ALOX15 P16050 1/20 0.30
MAPK1 P28482 1/20 0.30
HSD17B10 Q99714 1/20 0.30
PAX8 Q06710 1/20 0.30
SLC6A2 P23975 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
SCHEMBL25343738 0.86 SMYD2 (0.33) SMYD2SMN1; SMN2CYP3A4HTT
SCHEMBL31049119 0.85 SMYD2 (0.40) SMYD2SMN1; SMN2CYP3A4HTT
SCHEMBL6834292 0.83 SMYD2 (0.33) SMYD2SMN1; SMN2CYP3A4HTT
SCHEMBL8024698 0.83 MAOA (0.39) SMYD2SMN1; SMN2CYP3A4HTTEGFR
SCHEMBL7336991 0.83 SMYD2 (0.38) SMYD2SMN1; SMN2CYP3A4HTTMAPT
SCHEMBL2029952 0.82 TET2 (0.36) SMYD2SMN1; SMN2CYP3A4HTTMAPT
SCHEMBL15264417 0.82 SMYD2 (0.33) SMYD2SMN1; SMN2CYP3A4HTT
SCHEMBL1943280 0.82 GPR174 (0.38) GPR174SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL17375322 0.81 SMYD2 (0.35) SMYD2SMN1; SMN2CYP3A4HTTMEN1
SCHEMBL6833537 0.81 SMYD2 (0.33) SMYD2SMN1; SMN2CYP3A4HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180161446-A1 ANTIBODY DRUG CONJUGATE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USES THEREOF XDCEXPLORER (SHANGHAI) CO., LTD. (CN) 2018-06-14 US disclosed
EP-0701562-A1 UNSATURATED PHOSPHONATES DERIVATIVES OF PURINES AND PYRIMIDINES MERRELL DOW PHARMA (US) 1996-03-20 EP disclosed
US-5395931-A 6-amido-1-methyl-2-(substituted-thio)carbapenems MERCK & CO., INC. (US) 1995-03-07 US disclosed
WO-1994022882-A1 UNSATURATED PHOSPHONATES DERIVATIVES OF PURINES AND PYRIMIDINES MERRELL DOW PHARMACEUTICALS INC. (US) 1994-10-13 WO disclosed
EP-0350210-A2 Novel 6-amido-1-methyl-2-(substituted-thio)-carbapenems MERCK & CO. INC. (US) 1990-01-10 EP 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-20180161446-A1 ANTIBODY DRUG CONJUGATE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USES THEREOF FCGR3B, SI, INCENP SMYD2 1751/4885GPR174 4327/4885SMN1; SMN2 656/4885

“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.