SCHEMBL17425670

SCHEMBL17425670

CC1(C)c2ccccc2-c2ccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4cccc5c4sc4c(-c6ccccc6)cccc45)n3)cc21

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 12/20 0.36
LIMK1 P53667 1/20 0.36
ALOX5 P09917 1/20 0.32
PDE7A Q13946 1/20 0.32
PDE7B Q9NP56 1/20 0.32
ACACA Q13085 1/20 0.31
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
RARG P13631 1/20 0.31

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
SCHEMBL21319142 0.98 PDK2 (0.34) PDK2LIMK1ALOX5PDE7APDE7B
SCHEMBL17425583 0.98 LIMK1 (0.36) PDK2LIMK1ALOX5ACACA
SCHEMBL17425542 0.97 PDK2 (0.35) PDK2LIMK1ALOX5RARARARB
SCHEMBL17425537 0.97 LIMK1 (0.36) PDK2LIMK1ALOX5ACACA
SCHEMBL17425673 0.97 LIMK1 (0.36) PDK2LIMK1ALOX5ACACA
SCHEMBL29986676 0.97 LIMK1 (0.36) PDK2LIMK1ALOX5ACACA
SCHEMBL17640304 0.96 PDK2 (0.36) PDK2LIMK1ALOX5PDE7APDE7B
SCHEMBL30103502 0.96 LIMK1 (0.37) PDK2LIMK1ALOX5ACACA
SCHEMBL17425526 0.96 LIMK1 (0.37) PDK2LIMK1ALOX5ACACA
SCHEMBL17640468 0.94 PDK2 (0.36) PDK2LIMK1ALOX5RARARARB

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-20170054087-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-02-23 US disclosed
US-20160093808-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2016-03-31 US disclosed
US-20160028021-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2016-01-28 US disclosed
EP-2966706-A2 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2016-01-13 EP 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-20160028021-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, OR10J3 PDK2 1226/4885LIMK1 115/4885ALOX5 336/4885

“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.