SCHEMBL26459779

SCHEMBL26459779

CC(C)(C)c1cc2c(c(C(C)(C)C)c1)OC(=O)C2c1ccc(OCCCCCCOc2ccc(C3C(=O)Oc4c3cc(C(C)(C)C)cc4C(C)(C)C)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
HRH3 Q9Y5N1 2/20 0.34
GABBR2 O75899 1/20 0.34
GABBR1 Q9UBS5 1/20 0.34
LMNA P02545 3/20 0.34
MAPT P10636 2/20 0.34
PKM P14618 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
USP2 O75604 1/20 0.32
CXCR5 P32302 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
RAB9A P51151 2/20 0.32
POLB P06746 1/20 0.32
NPC1 O15118 1/20 0.32
MITF O75030 1/20 0.32
TP53 P04637 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL26459782 1.00 ALDH1A1 (0.35) ALDH1A1HPGDHRH3GABBR2GABBR1
SCHEMBL26459778 0.97 ALDH1A1 (0.35) ALDH1A1HPGDHRH3GABBR2GABBR1
SCHEMBL25522724 0.96 LMNA (0.39) LMNAMAPTNPC1TP53
SCHEMBL26459763 0.95 ALDH1A1 (0.36) ALDH1A1HPGDGABBR2GABBR1LMNA
SCHEMBL29478052 0.91 SMN1; SMN2 (0.37) ALDH1A1HPGDGABBR2GABBR1LMNA
SCHEMBL493787 0.91 SMN1; SMN2 (0.37) ALDH1A1HPGDGABBR2GABBR1LMNA
SCHEMBL27334072 0.91 LMNA (0.36) ALDH1A1HRH3LMNAMAPTMEN1
SCHEMBL30450985 0.91 LMNA (0.36) ALDH1A1HRH3LMNAMAPTMEN1
SCHEMBL26459777 0.91 ALDH1A1 (0.36) ALDH1A1HPGDGABBR2GABBR1KDM4E
SCHEMBL39521 0.90 ALDH1A1 (0.36) ALDH1A1HPGDGABBR2GABBR1MAPT

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-20230127329-A1 LACTONE COMPOUND FUJIFILM CORPORATION (JP) 2023-04-27 US disclosed
US-20230127329-A1 LACTONE COMPOUND FUJIFILM CORPORATION (JP) 2023-04-27 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-20230127329-A1 LACTONE COMPOUND LANCL1, GPX1, LOXL1 ALDH1A1 92/4885HPGD 401/4885HRH3 4728/4885

“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.