SCHEMBL13995119

SCHEMBL13995119

C[Si](C)(C)c1ccc(-c2c3ccccc3c(-c3c4ccccc4c(-c4ccc([Si](C)(C)C)cc4-c4ccccc4)c4ccccc34)c3ccccc23)c(-c2ccccc2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 3/20 0.38
▸ ACACA Q13085 2/20 0.34
▸ KDM4E B2RXH2 3/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ HPGD P15428 4/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ ENPP1 P22413 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MPI P34949 1/20 0.33
▸ ALOX5 P09917 1/20 0.32
▸ BACE1 P56817 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ BRD4 O60885 2/20 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
SCHEMBL13995118 0.87 GPR84 (0.36) GPR84ACACAKDM4EMEN1KMT2A
SCHEMBL13995120 0.84 PTGS2 (0.38) GPR84ACACAKDM4EMEN1KMT2A
SCHEMBL16805207 0.82 GPR84 (0.36) GPR84ACACAKDM4EMEN1KMT2A
SCHEMBL15453485 0.82 PTGS2 (0.37) KDM4EMEN1KMT2AESR2HPGD
SCHEMBL13995124 0.80 PTAFR (0.36) GPR84ACACAKDM4EMEN1KMT2A
SCHEMBL16263483 0.79 ACHE (0.38) GPR84ACACAKDM4EESR2ENPP1
SCHEMBL26761796 0.78 ENPP1 (0.38) GPR84KDM4EESR2HPGDSMN1; SMN2
SCHEMBL31367772 0.76 L3MBTL1 (0.46) KDM4EMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL23597356 0.76 ABCG2 (0.32) ACACAKDM4EMEN1KMT2AESR2
SCHEMBL13161623 0.76 CRHBP (0.40) KDM4EMEN1KMT2AHPGDSMN1; SMN2

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-8795847-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-08-05 — — US disclosed
US-8795847-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-08-05 — — US disclosed
US-20080303003-A1 Novel Materials for Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-12-11 — — 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-20080303003-A1 Novel Materials for Organic Electroluminescent Devices ANXA2, ANXA3, ANXA1 GPR84 4450/4885ACACA 707/4885KDM4E 3203/4885

“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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