SCHEMBL18385165

SCHEMBL18385165

CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4ccc(-c5ccc6c(c5)c5cc(-c7ccc8c9ccccc9n(-c9ccc%10c(c9)C(C)(C)c9ccccc9-%10)c8c7)ccc5n6-c5nc(-c6ccccc6)cc(-c6ccc(-c7ccccc7)cc6)n5)cc43)cc21

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.31
▸ TSPO P30536 1/20 0.31
▸ RXRA P19793 1/20 0.30
▸ RXRB P28702 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
SCHEMBL18385185 1.00 PDK2 (0.31) PDK2TSPORXRARXRB
SCHEMBL18385168 1.00 PDK2 (0.31) PDK2TSPORXRARXRB
SCHEMBL18385142 1.00 PDK2 (0.31) PDK2TSPORXRARXRB
SCHEMBL18385187 0.99 NPY5R (0.30) —
SCHEMBL18385158 0.99 NPY5R (0.30) —
SCHEMBL18385145 0.97 PDK2 (0.33) PDK2TSPO
SCHEMBL18385136 0.97 PDK2 (0.33) PDK2RXRARXRB
SCHEMBL18385135 0.97 PDK2 (0.33) PDK2RXRARXRB
SCHEMBL18385124 0.97 PDK2 (0.33) PDK2TSPO
SCHEMBL18385149 0.97 PDK2 (0.33) PDK2TSPO

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-20170018719-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-01-19 — — US disclosed
US-20170018719-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-01-19 — — 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-20170018719-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE CD99, BMI1, ETV6 PDK2 2418/4885TSPO 1974/4885RXRA 4156/4885

“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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