SCHEMBL17754063

SCHEMBL17754063

Cn1cc(C(=O)NCc2ccccc2)c2cc[nH]c2c1=O

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 13/20 0.71
▸ CECR2 Q9BXF3 2/20 0.55
▸ TAF1 P21675 1/20 0.55
▸ BRD9 Q9H8M2 1/20 0.55
▸ LMNA P02545 1/20 0.50
▸ TP53 P04637 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ PDE10A Q9Y233 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ PKM P14618 1/20 0.47

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
SCHEMBL17754058 0.88 BRD4 (0.55) BRD4CECR2TAF1BRD9LMNA
SCHEMBL17754064 0.88 BRD9 (0.55) BRD4CECR2TAF1BRD9ALDH1A1
SCHEMBL17754065 0.86 PDE10A (0.53) BRD4CECR2TAF1BRD9LMNA
SCHEMBL17753671 0.85 BRD4 (0.52) BRD4CECR2TAF1BRD9LMNA
SCHEMBL17753776 0.85 BRD4 (0.54) BRD4CECR2TAF1BRD9
SCHEMBL17754057 0.85 BRD4 (0.54) BRD4BRD9LMNAPDE10APOLB
SCHEMBL17754056 0.82 BRD9 (0.53) BRD4CECR2TAF1BRD9LMNA
SCHEMBL17748948 0.82 CECR2 (0.72) BRD4CECR2TAF1BRD9
SCHEMBL21227710 0.82 BRD4 (0.70) BRD4LMNATP53MAPTPDE10A
SCHEMBL17754069 0.82 ALDH1A1 (0.51) BRD4CECR2TAF1BRD9LMNA

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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