SCHEMBL21334490

SCHEMBL21334490

COC(=O)CCC(=O)OCCn1ccccc1=O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 1/20 0.49
MITF O75030 1/20 0.49
TP53 P04637 1/20 0.49
RAB9A P51151 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PSMB1 P20618 1/20 0.47
TSHR P16473 3/20 0.43
KDM4E B2RXH2 4/20 0.40
ALDH1A1 P00352 4/20 0.40
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
TNF P01375 1/20 0.38
AKT1 P31749 1/20 0.38

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
SCHEMBL27739460 0.80 L3MBTL1 (0.51) LMNASMN1; SMN2NPC1MITFTP53
SCHEMBL16090946 0.79 LMNA (0.45) LMNASMN1; SMN2NPC1MITFTP53
SCHEMBL7095748 0.77 KDM4E (0.53) SMN1; SMN2L3MBTL1PSMB1TSHRKDM4E
SCHEMBL15424625 0.76 L3MBTL1 (0.57) LMNASMN1; SMN2NPC1MITFTP53
SCHEMBL11528658 0.74 THRB (0.49) LMNASMN1; SMN2NPC1MITFTP53
SCHEMBL9752736 0.72 L3MBTL1 (0.60) LMNASMN1; SMN2NPC1MITFTP53
SCHEMBL9752573 0.71 L3MBTL1 (0.58) LMNASMN1; SMN2NPC1MITFTP53
SCHEMBL22645269 0.71 ALDH1A1 (0.44) LMNASMN1; SMN2RAB9ATSHRKDM4E
SCHEMBL26033356 0.71 MGLL (0.47) LMNASMN1; SMN2TP53RAB9ATSHR
SCHEMBL26032291 0.70 L3MBTL1 (0.45) LMNASMN1; SMN2NPC1MITFTP53

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-10406133-B2 Prodrugs of fumarates and their use in treating various diseases ALKERMES PHARMA IRELAND LIMITED (IE) 2019-09-10 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-10406133-B2 Prodrugs of fumarates and their use in treating various diseases FH, FAH, GLS2 LMNA 2354/4885SMN1; SMN2 1861/4885NPC1 352/4885

“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.