SCHEMBL17753993

SCHEMBL17753993

CC(C)N1CCC(CN(C)C(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 13/20 0.74
▸ CECR2 Q9BXF3 8/20 0.74
▸ TAF1 P21675 7/20 0.74
▸ BRD9 Q9H8M2 6/20 0.74
▸ TRIM24 O15164 1/20 0.40
▸ SMARCA2 P51531 1/20 0.40
▸ SMARCA4 P51532 1/20 0.40
▸ BRPF1 P55201 1/20 0.40
▸ EP300 Q09472 1/20 0.40
▸ PBRM1 Q86U86 1/20 0.40
▸ CREBBP Q92793 1/20 0.40
▸ BAZ2B Q9UIF8 1/20 0.40
▸ BAZ2A Q9UIF9 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
SCHEMBL17753946 0.94 BRD4 (0.68) BRD4CECR2TAF1BRD9TRIM24
SCHEMBL17753976 0.90 BRD4 (0.71) BRD4CECR2TAF1BRD9TRIM24
SCHEMBL17753959 0.90 BRD4 (0.72) BRD4CECR2TAF1BRD9TRIM24
SCHEMBL17753828 0.90 BRD4 (0.77) BRD4CECR2TAF1BRD9TRIM24
SCHEMBL17753674 0.88 BRD4 (0.60) BRD4CECR2TAF1BRD9TRIM24
SCHEMBL17753559 0.87 BRD4 (0.59) BRD4CECR2TAF1BRD9TRIM24
SCHEMBL17754001 0.86 BRD4 (0.58) BRD4CECR2TAF1BRD9TRIM24
SCHEMBL17753860 0.86 BRD4 (0.58) BRD4CECR2TAF1BRD9TRIM24
SCHEMBL19658813 0.86 BRD4 (0.60) BRD4CECR2TAF1BRD9TRIM24
Hydrochloric Acid SCHEMBL17749014 0.85 BRD4 (0.59) BRD4CECR2TAF1BRD9TRIM24

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-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
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 1/4885CECR2 184/4885TAF1 439/4885
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 BRD4 1/4885CECR2 184/4885TAF1 439/4885

“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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