SCHEMBL7965599

SCHEMBL7965599

COCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SMYD2 Q9NRG4 3/20 0.39
CA2 P00918 1/20 0.37
TSHR P16473 2/20 0.34
KCNH3 Q9ULD8 4/20 0.33
ALDH1A1 P00352 3/20 0.33
LMNA P02545 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HPGD P15428 1/20 0.33
POLB P06746 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
SCHEMBL24312364 0.89 SMN1; SMN2 (0.40) CYP3A4HTTSMN1; SMN2SMYD2CA2
SCHEMBL9572212 0.86 CYP3A4 (0.42) CYP3A4HTTSMN1; SMN2SMYD2CA2
SCHEMBL21176568 0.84 SMYD2 (0.39) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL706843 0.83 SMYD2 (0.40) CYP3A4HTTSMN1; SMN2SMYD2ALDH1A1
SCHEMBL25347656 0.83 SMYD2 (0.37) CYP3A4HTTSMN1; SMN2SMYD2ALDH1A1
SCHEMBL23461733 0.82 SMN1; SMN2 (0.39) CYP3A4HTTSMN1; SMN2SMYD2CA2
SCHEMBL1316789 0.81 SMYD2 (0.39) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL1726263 0.81 SMYD2 (0.39) CYP3A4HTTSMN1; SMN2SMYD2TDP1
SCHEMBL8194768 0.81 SMYD2 (0.39) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL453430 0.81 SMN1; SMN2 (0.44) CYP3A4HTTSMN1; SMN2SMYD2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2759538-B1 RADIOACTIVE FLUORINE LABELED COMPOUND NIHON MEDIPHYSICS CO LTD (JP) 2016-03-23 EP disclosed
US-9107964-B2 Radioactive fluorine-labeled compound NIHON MEDI-PHYSICS CO., LTD. (JP) 2015-08-18 US disclosed
US-20140364620-A1 RADIOACTIVE FLUORINE-LABELED COMPOUND NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2014-12-11 US disclosed
US-6194396-B1 ANTIALLERGENS; ANTIINFLAMMATION AGENTS; AUTOIMMUNE DISEASE; ANTISHOCK AGENTS; ANALGESICS; E.G., A 4 OR 7-PHENYLALKYLENE-OXYBENZIMIDAZOLE UNSUBSTITUTED OR SUBSTITUTED IN THE 1,2,3-POSITION WITH AN OXY, AMINO AND/OR THIO GROUP FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-02-27 US disclosed
US-6083961-A FOR PREVENTION AND/OR TREATMENT OF BRADYKININ OR ITS ANALOGUES MEDIATED DISEASES SUCH AS ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASE, SHOCK, PAIN FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-07-04 US disclosed
EP-0774462-A1 HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-21 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-20140364620-A1 RADIOACTIVE FLUORINE-LABELED COMPOUND AFF1, PRMT1, DOT1L CYP3A4 1827/4885HTT 1056/4885SMN1; SMN2 2063/4885

“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.