SCHEMBL23512003

SCHEMBL23512003

c1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3ccc4ccc5ccc6sc7ccccc7c6c5c4c3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 2/20 0.36
▸ CCND1 P24385 2/20 0.36
▸ F9 P00740 2/20 0.33
▸ APP P05067 1/20 0.32
▸ LIMK1 P53667 1/20 0.30
▸ CYP1A1 P04798 1/20 0.30
▸ CYP1B1 Q16678 1/20 0.30
▸ GPR3 P46089 1/20 0.30
▸ PIM3 Q86V86 1/20 0.30
▸ PTPN1 P18031 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
SCHEMBL23511901 0.98 CDK4 (0.38) CDK4CCND1F9APPLIMK1
SCHEMBL23511961 0.98 CDK4 (0.38) CDK4CCND1F9APPLIMK1
SCHEMBL23512000 0.98 CDK4 (0.34) CDK4CCND1F9CYP1A1CYP1B1
SCHEMBL25878926 0.95 CDK4 (0.37) CDK4CCND1F9APPLIMK1
SCHEMBL25879097 0.95 CDK4 (0.37) CDK4CCND1F9APPLIMK1
SCHEMBL25879012 0.95 CDK4 (0.37) CDK4CCND1F9APPLIMK1
SCHEMBL23512106 0.95 CDK4 (0.33) CDK4CCND1F9LIMK1CYP1A1
SCHEMBL23511898 0.94 CDK4 (0.38) CDK4CCND1F9APPLIMK1
SCHEMBL25878933 0.93 CDK4 (0.40) CDK4CCND1F9APPLIMK1
SCHEMBL25879013 0.93 CDK4 (0.34) CDK4CCND1F9APPLIMK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230006147-A1 PLURALITY OF HOST MATERIALS, ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2023-01-05 — — US disclosed
US-20210193933-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2021-06-24 — — US disclosed
US-20210184133-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, A PLURALITY OF HOST MATERIALS, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-06-17 — — 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-20230006147-A1 PLURALITY OF HOST MATERIALS, ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME NECTIN4, EPCAM, OR10J3 CDK4 1875/4885CCND1 3150/4885F9 2768/4885

“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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