SCHEMBL23184018

SCHEMBL23184018

CC(C)(C)c1nc(-c2ccc3c4ccccc4c4ccccc4c3c2)c2sc3ccccc3c2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 2/20 0.46
▸ TNKS2 Q9H2K2 2/20 0.46
▸ MAPT P10636 4/20 0.36
▸ PIM1 P11309 3/20 0.35
▸ PIM2 Q9P1W9 3/20 0.35
▸ HRH4 Q9H3N8 2/20 0.34
▸ LIMK1 P53667 3/20 0.34
▸ CDK5 Q00535 1/20 0.34
▸ CDK5R1 Q15078 1/20 0.34
▸ PIM3 Q86V86 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ KRAS P01116 1/20 0.33
▸ TNF P01375 1/20 0.33
▸ NOD1 Q9Y239 1/20 0.33
▸ ALOX5 P09917 1/20 0.32

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
SCHEMBL19161952 0.89 TNKS (0.45) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL19161619 0.87 TNKS (0.47) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL19162670 0.87 TNKS (0.46) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL23473704 0.86 TNKS (0.42) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL24623026 0.83 TNKS (0.38) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL23184019 0.81 TNKS (0.39) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL23473642 0.81 TNKS (0.39) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL20659764 0.80 TNKS (0.40) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL16581199 0.79 TNKS (0.39) TNKSTNKS2MAPTPIM1PIM2
SCHEMBL23473641 0.78 TNKS (0.36) TNKSTNKS2MAPTPIM1PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10968230-B2 Spiro-structured compound and organic electronic device comprising same LG CHEM, LTD. 2021-04-06 — — 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-10968230-B2 Spiro-structured compound and organic electronic device comprising same ESR1, OR10J3, ERG TNKS 4030/4885TNKS2 4072/4885MAPT 1988/4885

“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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