SCHEMBL17753971

SCHEMBL17753971

CN(CC1CCN(CC2CCC2)CC1)C(=O)c1cn(C)c(=O)c2[nH]ccc12

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 11/20 0.56
▸ CECR2 Q9BXF3 7/20 0.56
▸ TAF1 P21675 6/20 0.56
▸ BRD9 Q9H8M2 4/20 0.53
▸ ACHE P22303 2/20 0.43
▸ HTR4 Q13639 2/20 0.43
▸ SIGMAR1 Q99720 1/20 0.43

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
SCHEMBL17753691 0.98 BRD4 (0.56) BRD4CECR2TAF1BRD9ACHE
SCHEMBL17753868 0.97 BRD4 (0.56) BRD4CECR2TAF1BRD9ACHE
SCHEMBL17753813 0.92 BRD4 (0.54) BRD4CECR2TAF1BRD9ACHE
SCHEMBL17753999 0.90 BRD4 (0.51) BRD4CECR2TAF1BRD9ACHE
SCHEMBL17753559 0.89 BRD4 (0.59) BRD4CECR2TAF1BRD9
SCHEMBL17753989 0.89 BRD4 (0.55) BRD4CECR2TAF1BRD9ACHE
SCHEMBL17754001 0.89 BRD4 (0.58) BRD4CECR2TAF1BRD9
SCHEMBL17753806 0.88 BRD4 (0.52) BRD4CECR2TAF1BRD9
SCHEMBL17753959 0.88 BRD4 (0.72) BRD4CECR2TAF1BRD9
SCHEMBL17753992 0.88 BRD4 (0.52) BRD4CECR2TAF1BRD9

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-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
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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