SCHEMBL29596457

SCHEMBL29596457

CC[C@]1(c2ccccc2)COc2c(C(=O)NC)cc(C(=O)O)cc21

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 19/20 0.74
BRD2 P25440 1/20 0.52
BRD3 Q15059 1/20 0.52
BRDT Q58F21 1/20 0.52
F11 P03951 1/20 0.37

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
SCHEMBL20887624 1.00 BRD4 (0.74) BRD4BRD2BRD3BRDTF11
SCHEMBL20876232 1.00 BRD4 (0.74) BRD4BRD2BRD3BRDTF11
SCHEMBL22408534 0.94 BRD4 (0.78) BRD4BRD2BRD3BRDT
SCHEMBL29596053 0.94 BRD4 (0.78) BRD4BRD2BRD3BRDT
SCHEMBL20887560 0.94 BRD4 (0.78) BRD4BRD2BRD3BRDT
SCHEMBL29595960 0.91 BRD4 (0.75) BRD4BRD2BRD3BRDT
SCHEMBL20887670 0.91 BRD4 (0.75) BRD4BRD2BRD3BRDT
SCHEMBL20876249 0.91 BRD4 (0.75) BRD4BRD2BRD3BRDT
SCHEMBL22430938 0.90 BRD4 (0.73) BRD4BRD2BRD3BRDT
SCHEMBL22408444 0.90 BRD4 (0.73) BRD4BRD2BRD3BRDT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11319307-B2 2,3-dihydrobenzohurans as bromodomain inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2022-05-03 US 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 (1 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-11319307-B2 2,3-dihydrobenzohurans as bromodomain inhibitors BRD4, BRD3, BRPF3 BRD4 1/4885BRD2 4/4885BRD3 2/4885

“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.