SCHEMBL17952339

SCHEMBL17952339

Cc1cc(-c2ccccc2)ccc1N1c2c(C#N)cc(C#N)cc2N(C)[C@@H]1C

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ BRD4 O60885 2/20 0.32
▸ BRD2 P25440 1/20 0.32
▸ BRD3 Q15059 1/20 0.32
▸ EGLN1 Q9GZT9 1/20 0.31
▸ CYP11B1 P15538 1/20 0.30
▸ CYP11B2 P19099 1/20 0.30
▸ GRIA2 P42262 1/20 0.30
▸ GRIA4 P48058 1/20 0.30
▸ GABRA1 P14867 1/20 0.30
▸ GABRG2 P18507 1/20 0.30
▸ GABRB3 P28472 1/20 0.30
▸ GABRA5 P31644 1/20 0.30
▸ GABRA3 P34903 1/20 0.30
▸ GABRA2 P47869 1/20 0.30
▸ USP30 Q70CQ3 2/20 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
SCHEMBL17952325 0.91 KDM4E (0.34) KDM4EALDH1A1GLAGAABRD4
SCHEMBL17952337 0.91 GAA (0.34) KDM4EALDH1A1GLAGAABRD4
SCHEMBL17952196 0.86 SMN1; SMN2 (0.36) KDM4EALDH1A1GLAGAAEGLN1
SCHEMBL17952277 0.86 ALDH1A1 (0.36) KDM4EALDH1A1GLAGAACYP11B1
SCHEMBL17952113 0.86 TSHR (0.36) KDM4EALDH1A1GLAGAA
SCHEMBL17952253 0.85 GABRA1 (0.37) BRD4BRD2BRD3EGLN1CYP11B1
SCHEMBL17952117 0.85 NPSR1 (0.33) KDM4EALDH1A1GAA
SCHEMBL17952318 0.85 ALDH1A1 (0.37) KDM4EALDH1A1GLAGAABRD4
SCHEMBL17952284 0.84 ALDH1A1 (0.35) KDM4EALDH1A1GLAGAABRD4
SCHEMBL17952274 0.84 ALDH1A1 (0.36) KDM4EALDH1A1GLAGAAEGLN1

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-10418569-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2019-09-17 — — US disclosed
US-20160218303-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2016-07-28 — — 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 (2 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-10418569-B2 Organic electroluminescent materials and devices OCIAD2, OCIAD1, OSBP2 KDM4E 4426/4885ALDH1A1 1620/4885GLA 1850/4885
US-20160218303-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, OSBP2 KDM4E 4426/4885ALDH1A1 1620/4885GLA 1850/4885

“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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