SCHEMBL29344948

SCHEMBL29344948

CCCCOc1c(C(=O)OCC)occ(C(C)=O)c1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.40
GAA P10253 3/20 0.37
NPC1 O15118 3/20 0.37
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.36
TSHR P16473 3/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 4/20 0.35
HPGD P15428 3/20 0.35
KDM4E B2RXH2 3/20 0.35
RAB9A P51151 3/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 4/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
CA9 Q16790 2/20 0.34

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
SCHEMBL15143769 0.92 MAOB (0.48) MAOBGAANPC1L3MBTL1TSHR
SCHEMBL15928418 0.90 MAOB (0.40) MAOBGAANPC1L3MBTL1TSHR
SCHEMBL17928516 0.89 MAOB (0.42) MAOBNPC1L3MBTL1TSHRTDP1
SCHEMBL2601701 0.86 MAOB (0.45) MAOBNPC1L3MBTL1TSHRTDP1
SCHEMBL15928438 0.85 MAOB (0.40) MAOBGAANPC1L3MBTL1TSHR
SCHEMBL2600916 0.85 MAOB (0.46) MAOBNPC1L3MBTL1TSHRTDP1
SCHEMBL16181519 0.84 KDM4E (0.37) MAOBGAAL3MBTL1TSHRTDP1
SCHEMBL4549798 0.83 THRA (0.41) MAOBGAANPC1POLBL3MBTL1
SCHEMBL16638805 0.81 MAOB (0.45) MAOBGAANPC1L3MBTL1TSHR
SCHEMBL2601407 0.80 MAOB (0.41) MAOBNPC1L3MBTL1TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240238285-A1 POLYCYCLIC-CARBAMOYLPYRIDONE COMPOUNDS AND THEIR PHARMACEUTICAL USE GILEAD SCIENCES, INC. 2024-07-18 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-20240238285-A1 POLYCYCLIC-CARBAMOYLPYRIDONE COMPOUNDS AND THEIR PHARMACEUTICAL USE CCND3, PRCP, ZC3HAV1 MAOB 2689/4885GAA 2377/4885NPC1 859/4885

“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.