SCHEMBL17754057

SCHEMBL17754057

CCCCn1cc(C(=O)NCc2ccccc2)c2cc[nH]c2c1=O

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 3/20 0.54
▸ LMNA P02545 1/20 0.53
▸ CNR2 P34972 9/20 0.52
▸ CNR1 P21554 7/20 0.52
▸ PDE10A Q9Y233 1/20 0.50
▸ POLB P06746 1/20 0.48
▸ BRD9 Q9H8M2 1/20 0.48

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
SCHEMBL17754063 0.85 BRD4 (0.71) BRD4LMNAPDE10APOLBBRD9
SCHEMBL17754056 0.83 BRD9 (0.53) BRD4LMNAPDE10ABRD9
SCHEMBL17753991 0.78 BRD9 (0.53) BRD4CNR2CNR1PDE10ABRD9
SCHEMBL21227676 0.77 BRD4 (0.54) BRD4LMNACNR2CNR1PDE10A
SCHEMBL29019201 0.77 LMNA (0.75) LMNACNR2CNR1
SCHEMBL250298 0.76 CNR2 (0.61) BRD4LMNACNR2CNR1PDE10A
SCHEMBL249640 0.76 CNR2 (0.61) BRD4LMNACNR2CNR1PDE10A
SCHEMBL2736896 0.75 CNR2 (0.50) BRD4CNR2CNR1POLB
SCHEMBL17227678 0.74 BRD4 (0.62) BRD4LMNACNR2CNR1PDE10A
SCHEMBL2736842 0.74 CNR2 (0.61) BRD4LMNACNR2CNR1PDE10A

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 1/4885LMNA 2473/4885CNR2 213/4885
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 BRD4 1/4885LMNA 2473/4885CNR2 213/4885

“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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