SCHEMBL20151858

SCHEMBL20151858

CC(C)(C)OC(=O)CCC[PH](c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.38
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
ALPL P05186 2/20 0.35
ALPI P09923 2/20 0.35
ALPG P10696 2/20 0.35
PPARA Q07869 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 3/20 0.35
LMNA P02545 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
NPC1 O15118 1/20 0.35
GAA P10253 1/20 0.35
RAB9A P51151 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35

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
Bromide SCHEMBL28950639 0.98 HDAC8 (0.39) HDAC8L3MBTL1MTNR1AMTNR1BALPL
SCHEMBL28594635 0.90 MTNR1A (0.37) L3MBTL1MTNR1AMTNR1BALPLALPI
SCHEMBL24952223 0.84 LTA4H (0.38) HDAC8L3MBTL1KMT2A
SCHEMBL24951291 0.84 TLR2 (0.39) L3MBTL1MTNR1AMTNR1BCYP2C19HIF1A
SCHEMBL24952134 0.84 TLR2 (0.39) L3MBTL1MTNR1AMTNR1BCYP2C19HIF1A
SCHEMBL17361242 0.82 ALDH1A1 (0.51) ALDH1A1KDM4ELMNAMEN1KMT2A
Bromide SCHEMBL28529432 0.81 ALDH1A1 (0.50) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL1669392 0.80 CYP2C19 (0.39) MTNR1AMTNR1BCYP2C19HIF1AALDH1A1
SCHEMBL63753 0.79 CYP4F2 (0.50) L3MBTL1CYP2C19ALDH1A1PTPN1
SCHEMBL22481266 0.78 ALDH1A1 (0.53) HDAC8L3MBTL1ALDH1A1LMNAKMT2A

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-20180134674-A1 MAGL INHIBITORS H. LUNDBECK A/S (DK) 2018-05-17 US disclosed
US-20180134674-A1 MAGL INHIBITORS H. LUNDBECK A/S (DK) 2018-05-17 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-20180134674-A1 MAGL INHIBITORS MAG, MAGI3, MGLL HDAC8 2005/4885L3MBTL1 2479/4885MTNR1A 2310/4885

“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.