SCHEMBL19919637

SCHEMBL19919637

Cc1cc(C)cc(-c2ccc3c4ccc(-c5cc(C)cc(C)c5)cc4n(-c4cc(C#N)c(-c5cc(C)nc(C)c5)cc4-n4c5cc(-c6cc(C)cc(C)c6)ccc5c5ccc(-c6cc(C)cc(C)c6)cc54)c3c2)c1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 1/20 0.35
METAP2 P50579 1/20 0.33
PIK3CA P42336 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
MAOB P27338 3/20 0.32
MAOA P21397 3/20 0.32
IRAK4 Q9NWZ3 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
SCHEMBL19919639 0.94 GRIN1 (0.33) KDM5BMETAP2GRIN1GRIN2B
SCHEMBL19919841 0.92 KDM5B (0.35) KDM5BMETAP2PIK3CACYP11B1CYP11B2
SCHEMBL19919834 0.92 AR (0.37) PIK3CACYP11B1CYP11B2MAOBMAOA
SCHEMBL19919557 0.91 AR (0.41) KDM5B
SCHEMBL19909090 0.89 IRAK4 (0.34) IRAK4
SCHEMBL19909007 0.89 METAP2 (0.34) METAP2CYP11B1CYP11B2
SCHEMBL19919747 0.89 METAP2 (0.34) METAP2CYP11B1CYP11B2
SCHEMBL19913214 0.88 ALDH1A1 (0.31) MAOBMAOA
SCHEMBL19919830 0.88 CYP1A2 (0.40) CYP11B1CYP11B2
SCHEMBL19919817 0.88 CHEK1 (0.40) PIK3CACYP11B2IRAK4

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-11588114-B2 Organic molecules for use in optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-02-21 US disclosed
US-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-07-02 US disclosed
US-10665792-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2020-05-26 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 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 (3 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-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OPRM1, OR51E2 KDM5B 4454/4885METAP2 2365/4885PIK3CA 3731/4885
US-10665792-B2 Organic molecules for use in optoelectronic devices OR10J3, CFD, AOX1 KDM5B 4185/4885METAP2 3353/4885PIK3CA 4324/4885
US-11588114-B2 Organic molecules for use in optoelectronic devices OR10J3, OPRM1, OR51E2 KDM5B 4454/4885METAP2 2365/4885PIK3CA 3731/4885

“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.