SCHEMBL15732166

SCHEMBL15732166

COC(=O)c1cc(Cl)cc(N[C@H]2CC[C@@H](NC(=O)OC(C)(C)C)CC2)c1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 6/20 0.40
▸ DRD2 P14416 4/20 0.40
▸ DRD3 P35462 2/20 0.40
▸ CACNB4 O00305 1/20 0.40
▸ CACNA1A O00555 1/20 0.40
▸ CACNA1G O43497 1/20 0.40
▸ CACNG3 O60359 1/20 0.40
▸ CACNA1F O60840 1/20 0.40
▸ CACNA1H O95180 1/20 0.40
▸ CACNB3 P54284 1/20 0.40
▸ CACNA2D1 P54289 1/20 0.40
▸ CACNG7 P62955 1/20 0.40
▸ CACNA1B Q00975 1/20 0.40
▸ CACNA1D Q01668 1/20 0.40
▸ CACNB1 Q02641 1/20 0.40
▸ CACNG1 Q06432 1/20 0.40
▸ CACNB2 Q08289 1/20 0.40
▸ CACNA1S Q13698 1/20 0.40
▸ CACNA1C Q13936 1/20 0.40
▸ CACNA1E Q15878 1/20 0.40

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
SCHEMBL13280699 1.00 BTK (0.40) BTKDRD2DRD3CACNB4CACNA1A
SCHEMBL15710041 1.00 BTK (0.40) BTKDRD2DRD3CACNB4CACNA1A
SCHEMBL13281191 0.90 KDM1A (0.42) BTKDRD2DRD3CACNB4CACNA1A
SCHEMBL15710003 0.90 KDM1A (0.42) BTKDRD2DRD3CACNB4CACNA1A
SCHEMBL13280298 0.87 DRD2 (0.44) BTKDRD2DRD3CACNB4CACNA1A
SCHEMBL13276862 0.87 BTK (0.40) BTKDRD2DRD3KDM1AMAOB
SCHEMBL15711089 0.87 BTK (0.48) BTKDRD2DRD3CACNB4CACNA1A
SCHEMBL15732184 0.87 BTK (0.40) BTKDRD2DRD3KDM1AMAOB
SCHEMBL13467831 0.87 BTK (0.48) BTKDRD2DRD3CACNB4CACNA1A
SCHEMBL13276690 0.87 BTK (0.40) BTKDRD2DRD3KDM1AMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9382234-B2 Enhancer of Zeste Homolog 2 inhibitors GLAXOSMITHKLINE LLC (US) 2016-07-05 — — US disclosed
US-9382234-B2 Enhancer of Zeste Homolog 2 inhibitors GLAXOSMITHKLINE LLC (US) 2016-07-05 — — US disclosed
US-9382234-B2 Enhancer of Zeste Homolog 2 inhibitors GLAXOSMITHKLINE LLC (US) 2016-07-05 — — US disclosed
US-20150307480-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS GLAXOSMITHKLINE LLC 2015-10-29 — — US disclosed
US-20150307480-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS GLAXOSMITHKLINE LLC 2015-10-29 — — US disclosed
US-20150307480-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS GLAXOSMITHKLINE LLC 2015-10-29 — — US disclosed
EP-2931707-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS Glaxosmithkline LLC (US) 2015-10-21 — — EP disclosed
WO-2014107277-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS GLAXOSMITHKLINE LLC (US) 2014-07-10 — — WO disclosed
WO-2014107277-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS GLAXOSMITHKLINE LLC (US) 2014-07-10 — — WO disclosed
US-20140142083-A1 Substituted Benzene Compounds Epizyme, Inc. (US) 2014-05-22 — — 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-20150307480-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS EZH2, BMI1, EZH1 BTK 2088/4885DRD2 4782/4885DRD3 4805/4885
US-20140142083-A1 Substituted Benzene Compounds CYP1B1, TP53, VHL BTK 438/4885DRD2 1807/4885DRD3 1900/4885

“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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