SCHEMBL17754000

SCHEMBL17754000

Cn1cc(C(=O)NC2CCN(c3ccccn3)CC2)c2cc[nH]c2c1=O

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TAF1 P21675 4/20 0.70
▸ CECR2 Q9BXF3 4/20 0.70
▸ BRD9 Q9H8M2 3/20 0.70
▸ BRD4 O60885 6/20 0.46
▸ HMOX1 P09601 1/20 0.45
▸ DRD2 P14416 2/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ATAD2 Q6PL18 1/20 0.43
▸ HTR3A P46098 4/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ PARP1 P09874 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41

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
SCHEMBL17753958 0.90 TAF1 (0.74) TAF1CECR2BRD9BRD4MEN1
SCHEMBL17754073 0.88 TAF1 (0.69) TAF1CECR2BRD9BRD4ATAD2
SCHEMBL17753825 0.88 TAF1 (0.69) TAF1CECR2BRD9BRD4ATAD2
SCHEMBL17753565 0.88 TAF1 (0.69) TAF1CECR2BRD9BRD4ATAD2
SCHEMBL17749032 0.85 CECR2 (0.77) TAF1CECR2BRD9BRD4ATAD2
SCHEMBL17753909 0.83 TAF1 (1.00) TAF1CECR2BRD9BRD4ATAD2
SCHEMBL17753677 0.82 BRD9 (0.71) TAF1CECR2BRD9BRD4MEN1
SCHEMBL17753571 0.82 TAF1 (0.68) TAF1CECR2BRD9BRD4MEN1
SCHEMBL17753800 0.81 TAF1 (0.70) TAF1CECR2BRD9BRD4MEN1
SCHEMBL17753805 0.80 TAF1 (0.68) TAF1CECR2BRD9BRD4MEN1

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 TAF1 439/4885CECR2 184/4885BRD9 16/4885
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 TAF1 439/4885CECR2 184/4885BRD9 16/4885

“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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