SCHEMBL7003848

SCHEMBL7003848

Bc1ccc(SCC(=O)OCC)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
L3MBTL1 Q9Y468 3/20 0.48
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
PRNP P04156 1/20 0.46
MAPT P10636 2/20 0.45
GAA P10253 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 5/20 0.43
HPGD P15428 3/20 0.43
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TP53 P04637 1/20 0.43
HTT P42858 1/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP1A2 P05177 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL3162185 0.86 L3MBTL1 (0.60) LMNAL3MBTL1RAB9ANPC1MEN1
SCHEMBL2302836 0.84 KMT2A (0.50) LMNAL3MBTL1RAB9ANPC1MEN1
SCHEMBL2300941 0.83 ALDH1A1 (0.52) LMNAL3MBTL1RAB9ANPC1MEN1
SCHEMBL11539971 0.83 SMN1; SMN2 (0.56) LMNAL3MBTL1RAB9ANPC1MEN1
SCHEMBL14346586 0.83 MAPT (0.56) LMNAL3MBTL1RAB9ANPC1MEN1
SCHEMBL2027600 0.82 LMNA (0.59) LMNAL3MBTL1RAB9ANPC1MEN1
SCHEMBL5860967 0.81 ALDH1A1 (0.58) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL7243986 0.81 L3MBTL1 (0.50) LMNAL3MBTL1RAB9ANPC1MEN1
SCHEMBL1686764 0.81 NPC1 (0.52) LMNAL3MBTL1RAB9ANPC1MEN1
SCHEMBL13476511 0.80 LMNA (0.47) LMNAL3MBTL1RAB9ANPC1MEN1

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-20120295943-A9 CYCLOALKYLAMINE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-11-22 US disclosed
US-20120122941-A1 CYCLOALKYLAMINE DERIVATIVES MARUMOTO SHINJI (JP) 2012-05-17 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 (2 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-20120295943-A9 CYCLOALKYLAMINE DERIVATIVES CASR, CALCR, CALCRL LMNA 2694/4885L3MBTL1 1225/4885RAB9A 1707/4885
US-20120122941-A1 CYCLOALKYLAMINE DERIVATIVES CASR, CALCR, CALCRL LMNA 2694/4885L3MBTL1 1225/4885RAB9A 1707/4885

“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.