SCHEMBL17576282

SCHEMBL17576282

CCC(C)(CC)[Si](C)(c1ccccc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
NR1H2 P55055 2/20 0.33
NR1H3 Q13133 2/20 0.33
TP53 P04637 1/20 0.33
ELANE P08246 1/20 0.33
MAPT P10636 1/20 0.32
TAAR1 Q96RJ0 2/20 0.32
SLC6A2 P23975 1/20 0.32
RIPK1 Q13546 3/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
CASP3 P42574 1/20 0.32
RAB9A P51151 1/20 0.32
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 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
SCHEMBL15184948 0.87
SCHEMBL15800299 0.87 NPC1 (0.42) ESR1ESR2NR1H2NR1H3MAPT
SCHEMBL15127295 0.83 MAPT (0.30) MAPT
SCHEMBL16837409 0.79 TP53 (0.35) ESR1ESR2NR1H2NR1H3TP53
SCHEMBL6013056 0.75 ESR1 (0.41) ESR1ESR2NR1H2NR1H3ELANE
SCHEMBL15500759 0.75 RIPK1 (0.32) ESR1ESR2NR1H2NR1H3RIPK1
SCHEMBL15127296 0.75 NPC1 (0.32) ESR1ESR2NR1H2NR1H3NPC1
SCHEMBL16153139 0.73 ESR1 (0.35) ESR1ESR2NR1H2NR1H3TP53
SCHEMBL15276131 0.72 ESR1 (0.33) ESR1ESR2NR1H2NR1H3
SCHEMBL21120517 0.71 ESR1 (0.38) ESR1ESR2NR1H2NR1H3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170162802-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-06-08 US disclosed
US-20160072082-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2016-03-10 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-20170162802-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, KCNQ2 ESR1 82/4885ESR2 169/4885NR1H2 1826/4885
US-20160072082-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES EML4, TYR, CPNE4 ESR1 227/4885ESR2 221/4885NR1H2 4178/4885

“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.