SCHEMBL10045616

SCHEMBL10045616

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 1/20 0.38
▸ CDK5 Q00535 1/20 0.38
▸ CDK5R1 Q15078 1/20 0.38
▸ GPR3 P46089 1/20 0.38
▸ CDK4 P11802 1/20 0.38
▸ CCND1 P24385 1/20 0.38
▸ MAP3K9 P80192 1/20 0.38
▸ MAP3K11 Q16584 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ TNKS O95271 1/20 0.37
▸ TNKS2 Q9H2K2 1/20 0.37
▸ PTPN1 P18031 1/20 0.35
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ HPGD P15428 2/20 0.34
▸ ATM Q13315 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL10045597 0.83 ALDH1A1 (0.37) LIMK1CDK5CDK5R1GPR3CDK4
SCHEMBL10045614 0.83 L3MBTL1 (0.38) LIMK1CDK5CDK5R1GPR3CDK4
SCHEMBL13335309 0.81 GPR3 (0.41) LIMK1CDK5CDK5R1GPR3CDK4
SCHEMBL13335313 0.80 TNKS (0.35) LIMK1CDK5CDK5R1GPR3CDK4
SCHEMBL13335311 0.79 ALDH1A1 (0.34) GPR3CDK4CCND1MAP3K9MAP3K11
SCHEMBL13335314 0.76 APP (0.43) LIMK1CDK5CDK5R1GPR3CDK4
SCHEMBL21707437 0.75 GPR3 (0.41) LIMK1CDK5CDK5R1GPR3MAPT
SCHEMBL15853281 0.75 MAPT (0.34) MAPTATML3MBTL1
SCHEMBL1470735 0.73 ALDH1A1 (0.35) GPR3MAPTMEN1KMT2AKDM4E
SCHEMBL29690232 0.73 ALDH1A1 (0.35) GPR3MAPTMEN1KMT2AKDM4E

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
US-8101776-B2 Organic semiconductors and their manufacture BASF SE (DE) 2012-01-24 — — US disclosed
US-8101776-B2 Organic semiconductors and their manufacture BASF SE (DE) 2012-01-24 — — US disclosed
US-20110017981-A1 PROCESS FOR THE PREPARATION OF SEMICONDUCTING LAYERS BASF SE (US) 2011-01-27 — — US disclosed
US-20100117066-A1 Organic Semiconductors MERCK PATENT GMBH (DE) 2010-05-13 — — US disclosed
US-20090299070-A1 Organic Semiconductors and Their Manufacture CLAP CO., LTD. (KR) 2009-12-03 — — US disclosed
US-20090299070-A1 Organic Semiconductors and Their Manufacture CLAP CO., LTD. (KR) 2009-12-03 — — 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 (2 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 LIMK1 2161/4885CDK5 1827/4885CDK5R1 3528/4885
US-20090299070-A1 Organic Semiconductors and Their Manufacture YBX1, CDYL, PROX1 LIMK1 401/4885CDK5 2963/4885CDK5R1 3717/4885

“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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