SCHEMBL17749030

SCHEMBL17749030

Cn1cc(C(=O)NCC2CCCC2)c2cc[nH]c2c1=O

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TAF1 P21675 3/20 0.61
▸ CECR2 Q9BXF3 3/20 0.61
▸ BRD9 Q9H8M2 3/20 0.61
▸ BRD4 O60885 11/20 0.52
▸ P2RX7 Q99572 1/20 0.47
▸ PDE10A Q9Y233 2/20 0.47
▸ EZH2 Q15910 4/20 0.46
▸ KMT2A Q03164 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
SCHEMBL17754070 0.99 TAF1 (0.60) TAF1CECR2BRD9BRD4P2RX7
SCHEMBL17753694 0.99 TAF1 (0.60) TAF1CECR2BRD9BRD4P2RX7
SCHEMBL17753893 0.91 TAF1 (0.71) TAF1CECR2BRD9BRD4
SCHEMBL17753963 0.91 BRD9 (0.61) TAF1CECR2BRD9BRD4P2RX7
SCHEMBL17753695 0.90 TAF1 (0.58) TAF1CECR2BRD9BRD4
SCHEMBL17754174 0.90 CECR2 (0.59) TAF1CECR2BRD9BRD4EZH2
SCHEMBL17753701 0.89 TAF1 (0.54) TAF1CECR2BRD9BRD4EZH2
SCHEMBL17753692 0.86 TAF1 (0.56) TAF1CECR2BRD9BRD4
SCHEMBL17753713 0.85 TAF1 (0.58) TAF1CECR2BRD9BRD4EZH2
SCHEMBL17753688 0.83 KDM4E (0.55) TAF1CECR2BRD9BRD4KMT2A

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107108613-B Bromodomain inhibitors and uses thereof 基因泰克公司 2020-02-25 — — CN disclosed
US-10258603-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-04-16 — — US disclosed
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
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 — — US disclosed
EP-3218376-A1 BROMODOMAIN INHIBITORS AND USES THEREOF Genentech, Inc. (US) 2017-09-20 — — EP disclosed
WO-2016077375-A1 BROMODOMAIN INHIBITORS AND USES THEREOF GENENTECH, INC. (US) 2016-05-19 — — WO 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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