SCHEMBL17754064

SCHEMBL17754064

Cn1cc(C(=O)NCCc2ccccc2)c2cc[nH]c2c1=O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BRD9 Q9H8M2 2/20 0.55
▸ CECR2 Q9BXF3 2/20 0.55
▸ TAF1 P21675 1/20 0.55
▸ BRD4 O60885 5/20 0.55
▸ RAB9A P51151 3/20 0.51
▸ POLB P06746 1/20 0.51
▸ NPC1 O15118 1/20 0.48
▸ CNR2 P34972 1/20 0.47
▸ ADORA2A P29274 1/20 0.47
▸ ADORA1 P30542 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46

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 0.88 BRD4 (0.71) BRD9CECR2TAF1BRD4POLB
SCHEMBL17753664 0.86 CECR2 (0.53) BRD9CECR2TAF1BRD4RAB9A
SCHEMBL17748992 0.81 CECR2 (0.57) BRD9CECR2TAF1BRD4POLB
SCHEMBL17753900 0.79 BRD9 (0.60) BRD9CECR2TAF1BRD4KDM4E
SCHEMBL17753983 0.79 BRD9 (0.66) BRD9CECR2TAF1BRD4KDM4E
SCHEMBL17754058 0.77 BRD4 (0.55) BRD9CECR2TAF1BRD4ADORA2A
SCHEMBL17753895 0.77 TAF1 (0.58) BRD9CECR2TAF1BRD4KDM4E
SCHEMBL17753997 0.77 TAF1 (0.64) BRD9CECR2TAF1BRD4KDM4E
SCHEMBL17753966 0.77 BRD9 (0.64) BRD9CECR2TAF1BRD4
SCHEMBL17753671 0.77 BRD4 (0.52) BRD9CECR2TAF1BRD4KDM4E

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