SCHEMBL5449704

SCHEMBL5449704

CC(C)(C)[Si](OC[C@H]1O[C@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)[C@@H](O)[C@@H]1O)(c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 3/20 0.38
SLC6A2 P23975 1/20 0.34
ADORA1 P30542 2/20 0.34
CYP3A4 P08684 2/20 0.34
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MGAM O43451 1/20 0.33
TYMP P19971 1/20 0.32
SELP P16109 1/20 0.32

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
SCHEMBL5473045 1.00 SMYD2 (0.38) SMYD2SLC6A2ADORA1CYP3A4HTT
SCHEMBL14176118 0.94 SMYD2 (0.35) SMYD2SLC6A2ADORA1CYP3A4HTT
SCHEMBL13866337 0.94 SMYD2 (0.35) SMYD2SLC6A2ADORA1CYP3A4HTT
SCHEMBL17822565 0.93 SMYD2 (0.36) SMYD2SLC6A2ADORA1CYP3A4HTT
SCHEMBL16576331 0.93 SMYD2 (0.36) SMYD2SLC6A2ADORA1CYP3A4HTT
SCHEMBL5983168 0.93 SMYD2 (0.36) SMYD2SLC6A2ADORA1CYP3A4HTT
SCHEMBL1842898 0.93 SMYD2 (0.36) SMYD2SLC6A2ADORA1CYP3A4HTT
SCHEMBL1842894 0.93 SMYD2 (0.36) SMYD2SLC6A2ADORA1CYP3A4HTT
SCHEMBL19764252 0.93 SMYD2 (0.36) SMYD2SLC6A2ADORA1CYP3A4HTT
SCHEMBL28637106 0.93 SMYD2 (0.36) SMYD2SLC6A2ADORA1CYP3A4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070155971-A1 Chiral diphosphorus compounds and their transition metal complexes Source Global, PBC 2007-07-05 US disclosed
US-7193092-B2 Chiral diphosphorus compounds and their transition metal complexes LANXESS DEUTSCHLAND GMBH (DE) 2007-03-20 US disclosed
US-20050080047-A1 Chiral diphosphorus compounds and their transition metal complexes LANXESS DEUTSCHLAND GMBH (DE) 2005-04-14 US disclosed
US-20040127430-A1 Chiral monophosphorus compounds and their transition metal complexes LANXESS DEUTSCHLAND GMBH (DE) 2004-07-01 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 (3 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-20040127430-A1 Chiral monophosphorus compounds and their transition metal complexes MDM4, MPHOSPH6, AP3M1 SMYD2 3432/4885SLC6A2 2633/4885ADORA1 4008/4885
US-20070155971-A1 Chiral diphosphorus compounds and their transition metal complexes CDIPT, DCPS, PIN1 SMYD2 3610/4885SLC6A2 2539/4885ADORA1 2946/4885
US-20050080047-A1 Chiral diphosphorus compounds and their transition metal complexes CDIPT, DCPS, PIN1 SMYD2 3610/4885SLC6A2 2539/4885ADORA1 2946/4885

“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.