SCHEMBL13335311

SCHEMBL13335311

COC[Si](C#Cc1c2sc3ccccc3c2c(C#C[Si](COC)(COC)COC)c2sc3ccccc3c12)(COC)COC

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.34
▸ KDM4E B2RXH2 6/20 0.34
▸ MEN1 O00255 4/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ HPGD P15428 4/20 0.34
▸ HTT P42858 3/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ HCRTR1 O43613 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.33
▸ MAPT P10636 3/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ ATM Q13315 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ TNKS O95271 1/20 0.33

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
SCHEMBL10045614 0.84 L3MBTL1 (0.38) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL10045616 0.79 LIMK1 (0.38) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL10045597 0.75 ALDH1A1 (0.37) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL13335309 0.74 GPR3 (0.41) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL13335313 0.72 TNKS (0.35) MEN1KMT2ARAB9AMAPTTNKS
SCHEMBL13335314 0.69 APP (0.43) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL13335315 0.66 TNKS (0.36) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL10045611 0.65 TNKS (0.41) ALDH1A1KDM4ERAB9AMAPTATM
SCHEMBL15853288 0.63 ATM (0.35) MAPTATML3MBTL1
SCHEMBL17010959 0.63 GPR3 (0.60) ALDH1A1KDM4EMEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100117066-A1 Organic Semiconductors MERCK PATENT GMBH (DE) 2010-05-13 — — 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-20100117066-A1 Organic Semiconductors DBF4, DDT, SOAT1 ALDH1A1 2333/4885KDM4E 297/4885MEN1 3151/4885

“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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