SCHEMBL31407736

SCHEMBL31407736

CC(C)(C)OC(=O)c1ccc(Br)cn1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
ALDH1A1 P00352 1/20 0.55
GABRG2 P18507 13/20 0.46
GABRB3 P28472 13/20 0.46
GABRA1 P14867 12/20 0.46
GABRA2 P47869 12/20 0.46
GABRA5 P31644 12/20 0.46
GABRA3 P34903 11/20 0.46
GABRA6 Q16445 10/20 0.46
GABRA4 P48169 5/20 0.46
GABRP O00591 1/20 0.46
GABRD O14764 1/20 0.46
GABRB1 P18505 1/20 0.46
GABRB2 P47870 1/20 0.46
GABRE P78334 1/20 0.46
GABRG1 Q8N1C3 1/20 0.46
GABRG3 Q99928 1/20 0.46
GABRQ Q9UN88 1/20 0.46
MAPK1 P28482 1/20 0.42
DGAT1 O75907 1/20 0.40

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
SCHEMBL645688 1.00 KDM4E (0.55) KDM4EALDH1A1GABRG2GABRB3GABRA1
SCHEMBL13177597 0.87 KDM4E (0.51) KDM4EALDH1A1GABRG2GABRB3GABRA1
SCHEMBL27141575 0.84 KDM4E (0.49) KDM4EALDH1A1GABRG2GABRB3GABRA1
SCHEMBL13732052 0.82 GABRG2 (0.49) GABRG2GABRB3GABRA1GABRA2GABRA5
SCHEMBL8037078 0.81 GABRG2 (0.47) KDM4EALDH1A1GABRG2GABRB3GABRA1
SCHEMBL30978460 0.80 MAPK1 (0.65) KDM4EALDH1A1GABRG2GABRB3GABRA1
SCHEMBL109364 0.80 MAPK1 (0.65) KDM4EALDH1A1GABRG2GABRB3GABRA1
SCHEMBL31723056 0.79 GABRG2 (0.57) GABRG2GABRB3GABRA1GABRA2GABRA5
SCHEMBL30556510 0.79 GABRG2 (0.46) ALDH1A1GABRG2GABRB3GABRA1GABRA2
SCHEMBL15956221 0.79 GABRG2 (0.46) ALDH1A1GABRG2GABRB3GABRA1GABRA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260015313-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF PEPTIDREAM INC (JP) 2026-01-15 US disclosed
WO-2025262295-A1 PROTAC DEGRADERS OF MLLT1 AND/OR MLLT3 DARK BLUE THERAPEUTICS LTD (GB) 2025-12-26 WO disclosed
WO-2025262297-A1 PROTAC DEGRADERS OF MLLT1 AND/OR MLLT3 DARK BLUE THERAPEUTICS LTD (GB) 2025-12-26 WO disclosed
EP-4667467-A1 PROTAC DEGRADERS OF MLLT1 AND/OR MLLT3 Dark Blue Therapeutics Ltd (GB) 2025-12-24 EP disclosed
EP-4667466-A1 PROTAC DEGRADERS OF MLLT1 AND/OR MLLT3 Dark Blue Therapeutics Ltd (GB) 2025-12-24 EP disclosed
EP-4534524-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF PeptiDream Inc. (JP) 2025-04-09 EP 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-20260015313-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF NSUN3, BCAT1, SLC43A1 KDM4E 671/4885ALDH1A1 2330/4885GABRG2 2305/4885

“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.