SCHEMBL17749457

SCHEMBL17749457

CN(C)C1CCN(C(=O)c2cn(CCC3CC3)c(=O)c3[nH]ccc23)CC1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 5/20 0.53
▸ BRD9 Q9H8M2 12/20 0.51
▸ CECR2 Q9BXF3 16/20 0.48
▸ TAF1 P21675 13/20 0.48
▸ L3MBTL3 Q96JM7 1/20 0.42

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
SCHEMBL17752990 0.87 TAF1 (0.55) BRD4BRD9CECR2TAF1
SCHEMBL17753986 0.84 BRD4 (0.66) BRD4BRD9CECR2TAF1L3MBTL3
SCHEMBL17752998 0.84 TAF1 (0.55) BRD4BRD9CECR2TAF1
SCHEMBL17749015 0.80 BRD9 (0.58) BRD4BRD9CECR2TAF1
SCHEMBL17753865 0.79 BRD4 (0.64) BRD4BRD9CECR2TAF1L3MBTL3
SCHEMBL17753859 0.78 BRD4 (0.60) BRD4BRD9CECR2TAF1
SCHEMBL17754003 0.76 TAF1 (0.53) BRD4BRD9CECR2TAF1
SCHEMBL17753941 0.75 BRD4 (0.61) BRD4BRD9CECR2TAF1
SCHEMBL19658685 0.74 BRD4 (0.45) BRD4BRD9CECR2TAF1
SCHEMBL17753872 0.74 TAF1 (0.55) BRD4BRD9CECR2TAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107108613-B Bromodomain inhibitors and uses thereof 基因泰克公司 2020-02-25 — — CN disclosed
US-10258603-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-04-16 — — US disclosed
US-10258603-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-04-16 — — US disclosed
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 — — US disclosed
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 — — US disclosed
EP-3218376-A1 BROMODOMAIN INHIBITORS AND USES THEREOF Genentech, Inc. (US) 2017-09-20 — — EP disclosed
WO-2016077375-A1 BROMODOMAIN INHIBITORS AND USES THEREOF GENENTECH, INC. (US) 2016-05-19 — — WO disclosed
WO-2016077375-A1 BROMODOMAIN INHIBITORS AND USES THEREOF GENENTECH, INC. (US) 2016-05-19 — — WO 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-10258603-B2 Therapeutic compounds and uses thereof BRD4, BRDT, BRD3 BRD4 1/4885BRD9 16/4885CECR2 184/4885
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 BRD4 1/4885BRD9 16/4885CECR2 184/4885

“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.

Send feedback