SCHEMBL762137

SCHEMBL762137

C[Si](C)(C)c1ccc(N(c2ccc3c(-c4ccc5ccccc5c4)c4cc(N(c5ccc([Si](C)(C)C)cc5)c5cccc6ccccc56)ccc4c(-c4ccc5ccccc5c4)c3c2)c2cccc3ccccc23)cc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.34
CYP1A1 P04798 1/20 0.33
CYP1B1 Q16678 1/20 0.33
IKBKB O14920 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL762128 0.90 ESR1 (0.33) DHFRSIGMAR1
SCHEMBL761406 0.90 ESR1 (0.34) DHFRCYP1A1CYP1B1SIGMAR1ALDH1A1
SCHEMBL762131 0.89 IKBKB (0.36) CYP1A1CYP1B1IKBKBALDH1A1CYP1A2
SCHEMBL14424428 0.89 SIGMAR1 (0.34) DHFRCYP1A1CYP1B1SIGMAR1CYP1A2
SCHEMBL762134 0.88 SIGMAR1 (0.35) DHFRCYP1A1CYP1B1SIGMAR1
SCHEMBL760880 0.88 IKBKB (0.35) CYP1A1CYP1B1IKBKBALDH1A1CYP1A2
SCHEMBL14099642 0.88 CYP1A1 (0.35) DHFRCYP1A1CYP1B1IKBKBSIGMAR1
SCHEMBL761299 0.88 ENPP1 (0.38) DHFRALDH1A1CYP1A2CYP2C9HSD17B10
SCHEMBL761290 0.87 IKBKB (0.35) CYP1A1CYP1B1IKBKBALDH1A1CYP1A2
SCHEMBL13333637 0.87 SIGMAR1 (0.35) DHFRCYP1A1CYP1B1SIGMAR1

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
EP-1902013-B1 NOVEL ANTHRACENE DERIVATIVES, PROCESS FOR PREPARATION THEREOF, AND ORGANIC ELECTRONIC LIGHT EMITTING DEVICE USING THE SAME LG CHEMICAL LTD (KR) 2016-06-01 EP disclosed
US-8137823-B2 Anthracene derivatives, process for preparation thereof, and organic electronic light emitting device using the same LG CHEM, LTD. (KR) 2012-03-20 US disclosed
US-20090079334-A1 Novel Anthracene Derivatives, Process for Preparation Thereof, and Organic Electronic Light Emitting Device Using the Same LG CHEM, LTD. (KR) 2009-03-26 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-20090079334-A1 Novel Anthracene Derivatives, Process for Preparation Thereof, and Organic Electronic Light Emitting Device Using the Same XPOT, ALAD, APRT DHFR 3494/4885CYP1A1 46/4885CYP1B1 387/4885

“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.