SCHEMBL29545665

SCHEMBL29545665

CC(C)(C)OC(=O)n1cccc1-c1ccnc(-c2cc3ccc(C(F)(F)F)cc3o2)n1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 1/20 0.44
▸ HSP90AB1 P08238 1/20 0.44
▸ PIK3R1 P27986 1/20 0.41
▸ PIK3CA P42336 1/20 0.41
▸ EIF2AK4 Q9P2K8 7/20 0.37
▸ ATR Q13535 1/20 0.37
▸ TNK2 Q07912 1/20 0.37
▸ MAP2K4 P45985 1/20 0.35
▸ HRH3 Q9Y5N1 2/20 0.33
▸ MET P08581 1/20 0.33
▸ AXL P30530 1/20 0.33
▸ MERTK Q12866 1/20 0.33
▸ SYK P43405 2/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ KMO O15229 1/20 0.31
▸ SCN9A Q15858 1/20 0.31

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
SCHEMBL29546556 0.87 HSP90AA1 (0.50) HSP90AA1HSP90AB1PIK3R1PIK3CAEIF2AK4
SCHEMBL23416942 0.73 HSP90AA1 (0.51) HSP90AA1HSP90AB1PIK3R1PIK3CAEIF2AK4
SCHEMBL29797739 0.73 HSP90AA1 (0.51) HSP90AA1HSP90AB1PIK3R1PIK3CAEIF2AK4
SCHEMBL21074037 0.72 HSP90AA1 (0.61) HSP90AA1HSP90AB1PIK3R1PIK3CAATR
SCHEMBL29546690 0.69 HSP90AA1 (0.48) HSP90AA1HSP90AB1PIK3R1PIK3CAATR
SCHEMBL29546718 0.69 KDM4C (0.36) SYKKMO
SCHEMBL21823771 0.68 S1PR1 (0.40) HRH3
SCHEMBL24554242 0.68 HSP90AA1 (0.61) HSP90AA1HSP90AB1PIK3R1PIK3CAATR
SCHEMBL14923424 0.68 HSP90AA1 (0.61) HSP90AA1HSP90AB1PIK3R1PIK3CAATR
SCHEMBL29096122 0.68 HSP90AA1 (0.55) HSP90AA1HSP90AB1PIK3R1PIK3CAATR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3860994-B1 TRANSCRIPTION FACTOR BRN2 INHIBITORY COMPOUNDS AS THERAPEUTICS AND METHODS FOR THEIR USE UNIV BRITISH COLUMBIA (CA) 2024-08-14 — — EP disclosed
US-20220106304-A1 Transcription Factor BRN2 Inhibitory Compounds as Therapeutics and Methods for Their Use THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2022-04-07 — — 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-20220106304-A1 Transcription Factor BRN2 Inhibitory Compounds as Therapeutics and Methods for Their Use BRDT, CBFB, CREBBP HSP90AA1 2946/4885HSP90AB1 3173/4885PIK3R1 2603/4885

“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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