SCHEMBL26685246

SCHEMBL26685246

Cc1nnnn1[C@H]1CC[C@H](C(C)C)CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.37
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
TSHR P16473 8/20 0.35
LMNA P02545 4/20 0.34
NPSR1 Q6W5P4 7/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL22113418 0.79 TSHR (0.50) ALDH1A1MEN1KMT2ATSHRLMNA
SCHEMBL16426472 0.77 TSHR (0.53) ALDH1A1MEN1KMT2ATSHRLMNA
SCHEMBL24126973 0.75 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ATSHRLMNA
SCHEMBL9965906 0.74 ALDH1A1 (0.40) ALDH1A1MEN1KMT2ATSHRNPSR1
SCHEMBL17001650 0.74 ALOX15 (0.45) ALDH1A1MEN1KMT2ATSHRLMNA
Hydrochloric Acid SCHEMBL22528409 0.73 ALDH1A1 (0.39) ALDH1A1MEN1KMT2ATSHRNPSR1
SCHEMBL12435470 0.72 MEN1 (0.40) ALDH1A1MEN1KMT2ALMNANPSR1
SCHEMBL12436842 0.72 MEN1 (0.38) ALDH1A1MEN1KMT2ATSHRLMNA
SCHEMBL12436080 0.72 MEN1 (0.38) ALDH1A1MEN1KMT2ATSHRLMNA
SCHEMBL9963184 0.69 ALDH1A1 (0.51) ALDH1A1MEN1KMT2ATSHRLMNA

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
US-20230339937-A1 CONDENSED RING COMPOUNDS THAT INHIBIT H-PGDS SATO PHARMACEUTICAL CO., LTD. (JP) 2023-10-26 US disclosed
US-20230339937-A1 CONDENSED RING COMPOUNDS THAT INHIBIT H-PGDS SATO PHARMACEUTICAL CO., LTD. (JP) 2023-10-26 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-20230339937-A1 CONDENSED RING COMPOUNDS THAT INHIBIT H-PGDS HPGDS, PTGS1, PTGIS ALDH1A1 748/4885MEN1 4367/4885KMT2A 2511/4885

“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.