SCHEMBL12796362

SCHEMBL12796362

C[Si]1(C)c2cc(-c3cc4cccc5ccc6cccc3c6c54)ccc2-c2cc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5ccccc5c4)c3cc21

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ERBB2 P04626 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ FYN P06241 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ AHR P35869 1/20 0.34
▸ GPR84 Q9NQS5 1/20 0.33
▸ GSTP1 P09211 1/20 0.32
▸ HDAC4 P56524 1/20 0.31
▸ HDAC2 Q92769 1/20 0.31
▸ HDAC8 Q9BY41 1/20 0.31
▸ AKR1C3 P42330 1/20 0.30
▸ AKR1C2 P52895 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
SCHEMBL19844284 0.93 ERBB2 (0.35) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL18904357 0.91 ERBB2 (0.34) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL12796377 0.89 GSTP1 (0.32) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL12796343 0.89 GPR84 (0.38) CYP1A2GPR84GSTP1HDAC4HDAC2
SCHEMBL18904347 0.88 GSTP1 (0.37) CYP1A2GPR84GSTP1HDAC4HDAC2
SCHEMBL18904378 0.88 ALDH1A1 (0.36) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL12796369 0.88 TSHR (0.35) CYP1A2GPR84GSTP1HDAC4HDAC2
SCHEMBL12796335 0.87 GSTP1 (0.36) CYP1A2GPR84GSTP1HDAC4HDAC2
SCHEMBL12796344 0.86 HDAC4 (0.36) CYP1A2GPR84GSTP1HDAC4HDAC2
SCHEMBL18904362 0.86 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10720473-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2020-07-21 — — US disclosed
US-20190296091-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2019-09-26 — — US disclosed
US-10361252-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2019-07-23 — — US disclosed
US-20180040827-A1 ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2018-02-08 — — US disclosed
US-20180040827-A1 ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2018-02-08 — — US disclosed
US-20170154931-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-01 — — US disclosed
US-20170154931-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-01 — — US disclosed
US-8395144-B2 Anthracene derivatives and organic electroluminescent device using same DOOSAN CORPORATION (KR) 2013-03-12 — — US disclosed
US-20110057182-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME DOOSAN CORPORATION (KR) 2011-03-10 — — 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 (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-20110057182-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME TRPA1, AHR, ORAI2 ERBB2 2775/4885CYP1A2 29/4885FYN 1451/4885

“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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