SCHEMBL29293111

SCHEMBL29293111

CC(C)(C)c1cc(-c2ccccc2-c2cccc3c2sc2c(-c4ccc(-c5cccnc5)cc4)cccc23)cc(C(C)(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 2/20 0.49
▸ PTGS2 P35354 1/20 0.38
▸ CYP17A1 P05093 2/20 0.37
▸ CYP1A2 P05177 2/20 0.37
▸ PDE10A Q9Y233 1/20 0.37
▸ CYP11B1 P15538 2/20 0.36
▸ CYP2A6 P11509 2/20 0.35
▸ MKNK1 Q9BUB5 1/20 0.35
▸ MKNK2 Q9HBH9 1/20 0.35
▸ CYP19A1 P11511 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35
▸ PDK2 Q15119 1/20 0.34
▸ LIMK1 P53667 1/20 0.34
▸ PIK3CA P42336 1/20 0.34
▸ DHODH Q02127 1/20 0.34
▸ EDNRB P24530 1/20 0.34
▸ EDNRA P25101 1/20 0.34
▸ CLK1 P49759 1/20 0.34
▸ DYRK1A Q13627 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33

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
SCHEMBL29293109 0.95 KIF11 (0.54) KIF11PTGS2CYP17A1CYP1A2PDE10A
SCHEMBL29293110 0.93 KIF11 (0.54) KIF11PTGS2CYP1A2PDE10ACYP11B1
SCHEMBL29293207 0.90 KIF11 (0.48) KIF11CYP1A2PDE10ACYP11B1CYP2A6
SCHEMBL29293043 0.87 KIF11 (0.66) KIF11PTGS2CYP1A2PDE10ACYP11B1
SCHEMBL29293255 0.86 CYP19A1 (0.42) PTGS2CYP17A1CYP1A2PDE10ACYP11B1
SCHEMBL29293254 0.86 CYP1A2 (0.44) KIF11PTGS2CYP17A1CYP1A2PDE10A
SCHEMBL29293030 0.86 CYP1A2 (0.44) KIF11PTGS2CYP17A1CYP1A2PDE10A
SCHEMBL29293152 0.84 KIF11 (0.47) KIF11CYP1A2PDE10ACYP11B1CYP2A6
SCHEMBL29293113 0.83 LIMK1 (0.46) KIF11PTGS2CYP17A1CYP1A2PDE10A
SCHEMBL29293139 0.83 PTGS2 (0.49) KIF11PTGS2CYP17A1CYP1A2PDE10A

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-20240228470-A1 Organic Compound And Organic Light Emitting Device Including Same P&H TECH CO., LTD (KR) 2024-07-11 — — US disclosed
US-20240228470-A1 Organic Compound And Organic Light Emitting Device Including Same P&H TECH CO., LTD (KR) 2024-07-11 — — 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-20240228470-A1 Organic Compound And Organic Light Emitting Device Including Same OR10J3, ORMDL3, OR51E2 KIF11 1603/4885PTGS2 3462/4885CYP17A1 1625/4885

“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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