SCHEMBL10109248

SCHEMBL10109248

CC1(C)c2cc(Nc3ccc(-c4ccccc4)cc3)ccc2-c2ccc3sc4ccccc4c3c21

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.34
▸ MAP3K8 P41279 2/20 0.33
▸ PTGIR P43119 1/20 0.32
▸ HDAC1 Q13547 1/20 0.32
▸ IDO1 P14902 2/20 0.31
▸ F9 P00740 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ DUSP3 P51452 1/20 0.30
▸ BLM P54132 1/20 0.30
▸ PTPN5 P54829 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ PTPN11 Q06124 1/20 0.30
▸ MCL1 Q07820 1/20 0.30
▸ CTDSP1 Q9GZU7 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ ACLY P53396 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
SCHEMBL16475619 0.85 PTGIR (0.31) PTGIR
SCHEMBL17945768 0.84 MEN1 (0.34) PDK2F9MEN1POLBMAPT
SCHEMBL17550923 0.84 PTGIR (0.38) PDK2MAP3K8PTGIRHDAC1IDO1
SCHEMBL23372693 0.83 MAP3K8 (0.34) PDK2MAP3K8F9MEN1MAPT
SCHEMBL17690164 0.83 PDK2 (0.38) PDK2PTGIRIDO1F9
SCHEMBL25003257 0.83 PDK2 (0.34) PDK2
SCHEMBL23372691 0.83 F9 (0.34) PDK2F9
SCHEMBL21863063 0.82 ALK (0.33) F9MEN1POLBMAPTDUSP3
SCHEMBL24406557 0.81 ALK (0.33) F9MEN1POLBMAPTDUSP3
SCHEMBL23372692 0.81 MAP3K8 (0.33) MAP3K8IDO1ACLY

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-9246107-B2 Compound for organic optoelectronic device, organic light emitting diode including the same and display device including the organic light emitting diode CHEIL INDUSTRIES, INC. (KR) 2016-01-26 — — US disclosed
US-9246107-B2 Compound for organic optoelectronic device, organic light emitting diode including the same and display device including the organic light emitting diode CHEIL INDUSTRIES, INC. (KR) 2016-01-26 — — US disclosed
US-20120112174-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2012-05-10 — — US disclosed
US-20120112174-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2012-05-10 — — 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-20120112174-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT EMITTING DIODE AOX1, OCIAD1, OCIAD2 PDK2 1621/4885MAP3K8 1824/4885PTGIR 3321/4885

“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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