SCHEMBL16641248

SCHEMBL16641248

C=COc1cc2ccc3c(OC=C)cccc3c2c(OC=C)c1OC=C

nearest known ligand 0.34

Predicted protein targets (top 6)

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

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
SCHEMBL29592477 0.76 ADRA2B (0.33) —
SCHEMBL3124235 0.76 ADRA2B (0.33) —
SCHEMBL13899918 0.74 HPRT1 (0.52) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL13899922 0.72 CYP1A2 (0.47) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL13588215 0.69 CYP1A2 (0.38) CYP1A2
SCHEMBL194724 0.69 HTR1B (0.46) CYP1A2
SCHEMBL29790427 0.69 HTR1B (0.46) CYP1A2
SCHEMBL4838631 0.68 ADRA2B (0.33) —
SCHEMBL29592315 0.68 IMPDH2 (0.38) CYP1A2
SCHEMBL17063035 0.68 IMPDH2 (0.38) CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9394482-B2 Polymerizable compound, polymerizable composition and liquid crystal display device JNC CORPORATION (JP) 2016-07-19 — — US disclosed
US-9394482-B2 Polymerizable compound, polymerizable composition and liquid crystal display device JNC CORPORATION (JP) 2016-07-19 — — US disclosed
US-20150102259-A1 POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2015-04-16 — — US disclosed
US-20150102259-A1 POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2015-04-16 — — 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-20150102259-A1 POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE NCAPD3, LEO1, PYM1 ERBB2 1962/4885CYP1A2 175/4885FYN 533/4885

“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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