SCHEMBL10653589

SCHEMBL10653589

CC(C)(C)C(=O)/C=C/c1ccco1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.62
MAPT P10636 9/20 0.54
POLB P06746 8/20 0.54
ALDH1A1 P00352 7/20 0.54
L3MBTL1 Q9Y468 6/20 0.54
HTT P42858 2/20 0.54
PKM P14618 2/20 0.54
MASP2 O00187 1/20 0.53
F2 P00734 1/20 0.53
RAB9A P51151 5/20 0.53
KMT2A Q03164 5/20 0.53
KDM4E B2RXH2 4/20 0.53
MEN1 O00255 4/20 0.53
NPC1 O15118 4/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
ABCG2 Q9UNQ0 1/20 0.51
LMNA P02545 2/20 0.51
NFKB1 P19838 2/20 0.51

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
SCHEMBL10653590 1.00 HCAR2 (0.62) HCAR2MAPTPOLBALDH1A1L3MBTL1
SCHEMBL27712545 0.82 HCAR2 (0.62) HCAR2MAPTPOLBALDH1A1L3MBTL1
SCHEMBL370268 0.79 HCAR2 (0.69) HCAR2MAPTPOLBALDH1A1L3MBTL1
SCHEMBL859081 0.79 HCAR2 (0.69) HCAR2MAPTPOLBALDH1A1L3MBTL1
SCHEMBL979497 0.79 HCAR2 (0.74) HCAR2MAPTPOLBALDH1A1L3MBTL1
SCHEMBL7142763 0.79 HCAR2 (0.74) HCAR2MAPTPOLBALDH1A1L3MBTL1
SCHEMBL979495 0.79 HCAR2 (0.74) HCAR2MAPTPOLBALDH1A1L3MBTL1
SCHEMBL8104407 0.78 MAPT (0.63) HCAR2MAPTPOLBALDH1A1L3MBTL1
SCHEMBL125126 0.77 HCAR2 (1.00) HCAR2MAPTPOLBALDH1A1L3MBTL1
SCHEMBL2561722 0.77 HCAR2 (1.00) HCAR2MAPTPOLBALDH1A1L3MBTL1

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-11731967-B2 Inhibitors of TRIM33 and methods of use DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-08-22 US disclosed
US-11731967-B2 Inhibitors of TRIM33 and methods of use DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-08-22 US disclosed
EP-0275704-A1 1,2,4-Triazole derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-07-27 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-11731967-B2 Inhibitors of TRIM33 and methods of use TRIM33, TRIM28, TRIM4 HCAR2 4029/4885MAPT 1086/4885POLB 423/4885

“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.