SCHEMBL13997161

SCHEMBL13997161

C1CCC(n2nnnc2SSc2nnnn2C2CCCCC2)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.59
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
ALDH1A1 P00352 13/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
TSHR P16473 5/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
TDP1 Q9NUW8 2/20 0.49
HPGD P15428 2/20 0.49
HSD17B10 Q99714 2/20 0.49
PKM P14618 1/20 0.49
KDM4E B2RXH2 1/20 0.49
ALOX15 P16050 1/20 0.49
LMNA P02545 3/20 0.49
TP53 P04637 2/20 0.49
MAPT P10636 2/20 0.49
GAA P10253 1/20 0.48
RECQL P46063 1/20 0.48
NPY1R P25929 1/20 0.48

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
SCHEMBL10969531 0.80 L3MBTL1 (0.64) L3MBTL1MEN1KMT2AALDH1A1NPC1
SCHEMBL6888161 0.76 L3MBTL1 (1.00) L3MBTL1MEN1KMT2AALDH1A1NPC1
SCHEMBL10973437 0.76 ALDH1A1 (0.60) L3MBTL1MEN1KMT2AALDH1A1NPC1
SCHEMBL7269040 0.74 MEN1 (0.58) L3MBTL1MEN1KMT2AALDH1A1NPC1
SCHEMBL16426472 0.73 TSHR (0.53) L3MBTL1MEN1KMT2AALDH1A1NPC1
SCHEMBL1013139 0.73 TSHR (0.53) L3MBTL1MEN1KMT2AALDH1A1NPC1
SCHEMBL20816366 0.73 TSHR (0.53) L3MBTL1MEN1KMT2AALDH1A1NPC1
SCHEMBL10968155 0.73 L3MBTL1 (0.56) L3MBTL1MEN1KMT2AALDH1A1NPC1
SCHEMBL8042825 0.72 ALDH1A1 (0.49) L3MBTL1MEN1KMT2AALDH1A1NPC1
SCHEMBL10973583 0.72 ALDH1A1 (0.57) L3MBTL1MEN1KMT2AALDH1A1NPC1

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-20080317834-A1 Compounds and methods for modulating cerebral amyloid angiopathy NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2008-12-25 US disclosed
US-20080317834-A1 Compounds and methods for modulating cerebral amyloid angiopathy NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2008-12-25 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-20080317834-A1 Compounds and methods for modulating cerebral amyloid angiopathy APP, PYGB, MAPT L3MBTL1 4289/4885MEN1 1863/4885KMT2A 3285/4885

“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.