SCHEMBL22639809

SCHEMBL22639809

Cc1cc(OC[C@@H](O)CN2CCOCC2)ccc1Cl

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
KMT2A Q03164 3/20 0.65
MAPK1 P28482 3/20 0.65
GAA P10253 1/20 0.65
MAPT P10636 2/20 0.65
TP53 P04637 1/20 0.65
NPC1 O15118 1/20 0.64
USP2 O75604 1/20 0.60
TSHR P16473 1/20 0.60
LMNA P02545 1/20 0.60
PKM P14618 1/20 0.59
MEN1 O00255 1/20 0.59

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
SCHEMBL22639911 1.00 L3MBTL1 (0.67) L3MBTL1SMN1; SMN2KMT2AMAPK1GAA
SCHEMBL22639790 0.89 POLB (0.72) L3MBTL1SMN1; SMN2KMT2AMAPTTP53
SCHEMBL16370714 0.89 L3MBTL1 (0.71) L3MBTL1SMN1; SMN2KMT2AMAPK1GAA
SCHEMBL16370581 0.89 L3MBTL1 (0.71) L3MBTL1SMN1; SMN2KMT2AMAPK1GAA
SCHEMBL16370933 0.89 L3MBTL1 (0.71) L3MBTL1SMN1; SMN2KMT2AMAPK1GAA
SCHEMBL22639857 0.89 POLB (0.72) L3MBTL1SMN1; SMN2KMT2AMAPTTP53
SCHEMBL16371024 0.89 L3MBTL1 (0.71) L3MBTL1SMN1; SMN2KMT2AMAPK1GAA
Hydrochloric Acid SCHEMBL16371042 0.88 MAPK1 (0.72) L3MBTL1SMN1; SMN2KMT2AMAPK1GAA
SCHEMBL4578170 0.83 USP2 (0.83) L3MBTL1SMN1; SMN2KMT2AMAPK1GAA
SCHEMBL12834994 0.82 USP2 (0.81) L3MBTL1SMN1; SMN2KMT2AMAPK1GAA

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-10828281-B2 Non-hydrophobic compounds for use in treating metastasis and/or cartilage defect Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2020-11-10 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-10828281-B2 Non-hydrophobic compounds for use in treating metastasis and/or cartilage defect VIM, MATR3, TP53 L3MBTL1 715/4885SMN1; SMN2 2515/4885KMT2A 4613/4885

“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.