SCHEMBL14998074

SCHEMBL14998074

CC(C)(CC(C#Cc1ccccc1)CCc1ccccc1)[Si](O)(c1ccccc1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 3/20 0.33
▸ FFAR4 Q5NUL3 2/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ SIGMAR1 Q99720 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MME P08473 1/20 0.31
▸ PRSS1 P07477 2/20 0.31
▸ CTSG P08311 2/20 0.31
▸ CTRB1 P17538 2/20 0.31
▸ CMA1 P23946 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ CTSS P25774 1/20 0.31
▸ CTSK P43235 1/20 0.31
▸ HTT P42858 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ HPGD P15428 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
SCHEMBL14998076 0.87 FFAR1 (0.33) FFAR1MEN1KMT2ATSHRMME
SCHEMBL12284775 0.78 TSHR (0.39) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL12284530 0.76 CYP19A1 (0.41) TSHR
SCHEMBL10086873 0.73 TSHR (0.34) MEN1KMT2ATSHRMMEPRSS1
SCHEMBL9608678 0.69 CTSK (0.31) CTSK
SCHEMBL14997680 0.69 MEN1 (0.32) MEN1KMT2AALDH1A1SIGMAR1PRSS1
SCHEMBL15886149 0.69 GAA (0.36) ALDH1A1SMN1; SMN2
SCHEMBL28896083 0.68 SIGMAR1 (0.45) FFAR1FFAR4MEN1KMT2AALDH1A1
SCHEMBL2684779 0.68 FFAR1 (0.43) FFAR1FFAR4MEN1KMT2AALDH1A1
SCHEMBL13355355 0.67 LTB4R (0.42) SIGMAR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993470-B2 Catalysts for the alkyne metathesis STUDIENGESELLSCHAFT KOHLE MBH (DE) 2015-03-31 — — US disclosed
EP-2556078-B1 CATALYSTS FOR ALKYNE METATHESIS STUDIENGESELLSCHAFT KOHLE MBH (DE) 2014-09-24 — — EP disclosed
US-20130144102-A1 CATALYSTS FOR THE ALKYNE METATHESIS STUDIENGESELLSCHAFT KOHLE MBH (DE) 2013-06-06 — — 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-20130144102-A1 CATALYSTS FOR THE ALKYNE METATHESIS MSH6, AP3M1, PMS2 FFAR1 4642/4885FFAR4 4808/4885MEN1 29/4885

“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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