SCHEMBL17754104

SCHEMBL17754104

C[C@H](NC(=O)c1cn(C)c(=O)c2[nH]ccc12)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CECR2 Q9BXF3 4/20 0.54
▸ TAF1 P21675 4/20 0.54
▸ BRD4 O60885 4/20 0.54
▸ BRD9 Q9H8M2 3/20 0.54
▸ TP53 P04637 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ PDE10A Q9Y233 1/20 0.47
▸ ALDH1A1 P00352 4/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ POLB P06746 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ HPGD P15428 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ ADORA2A P29274 1/20 0.46
▸ ADORA1 P30542 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ CNR1 P21554 1/20 0.45
▸ CNR2 P34972 1/20 0.45

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
SCHEMBL19639705 1.00 CECR2 (0.54) CECR2TAF1BRD4BRD9TP53
SCHEMBL17748995 1.00 CECR2 (0.54) CECR2TAF1BRD4BRD9TP53
SCHEMBL17753771 0.89 CECR2 (0.55) CECR2TAF1BRD4BRD9
SCHEMBL17753686 0.89 BRD4 (0.52) CECR2TAF1BRD4BRD9ALDH1A1
SCHEMBL17753665 0.89 TAF1 (0.52) CECR2TAF1BRD4BRD9PDE10A
SCHEMBL17753666 0.89 CECR2 (0.52) CECR2TAF1BRD4BRD9ALDH1A1
SCHEMBL17754172 0.89 BRD4 (0.52) CECR2TAF1BRD4BRD9PDE10A
SCHEMBL17753693 0.87 CECR2 (0.53) CECR2TAF1BRD4BRD9
SCHEMBL17754062 0.85 CECR2 (0.51) CECR2TAF1BRD4BRD9
SCHEMBL17753698 0.85 CECR2 (0.51) CECR2TAF1BRD4BRD9

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

“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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