SCHEMBL17752992

SCHEMBL17752992

CC1CCN(C2CCN(C(=O)c3cn(C)c(=O)c4[nH]ccc34)CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 10/20 0.55
▸ CECR2 Q9BXF3 6/20 0.55
▸ TAF1 P21675 5/20 0.55
▸ BRD9 Q9H8M2 4/20 0.53
▸ KDM4E B2RXH2 1/20 0.51
▸ ATAD2 Q6PL18 2/20 0.46
▸ L3MBTL3 Q96JM7 3/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ TP53BP1 Q12888 2/20 0.42
▸ MBTD1 Q05BQ5 1/20 0.42
▸ CCR3 P51677 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
SCHEMBL17753000 0.94 BRD4 (0.60) BRD4CECR2TAF1BRD9ATAD2
SCHEMBL17753853 0.91 BRD4 (0.55) BRD4CECR2TAF1BRD9ATAD2
SCHEMBL17752988 0.90 BRD4 (0.54) BRD4CECR2TAF1BRD9ATAD2
SCHEMBL17753003 0.90 TAF1 (0.60) BRD4CECR2TAF1BRD9ATAD2
SCHEMBL17752999 0.89 TAF1 (0.49) BRD4CECR2TAF1BRD9ATAD2
SCHEMBL17752991 0.88 TAF1 (0.58) BRD4CECR2TAF1BRD9ATAD2
SCHEMBL17753943 0.85 TAF1 (0.58) BRD4CECR2TAF1BRD9ATAD2
SCHEMBL17752996 0.82 TAF1 (0.55) BRD4CECR2TAF1BRD9KDM4E
SCHEMBL17753007 0.82 TAF1 (0.55) BRD4CECR2TAF1BRD9ATAD2
SCHEMBL17752989 0.82 CECR2 (0.55) BRD4CECR2TAF1BRD9ATAD2

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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