SCHEMBL12017484

SCHEMBL12017484

CNC(=O)COc1ccccc1NC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
ALDH1A1 P00352 3/20 0.50
CYP1A2 P05177 1/20 0.50
POLB P06746 3/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
KDM4E B2RXH2 3/20 0.49
GAA P10253 1/20 0.49
HSD17B10 Q99714 1/20 0.49
RAB9A P51151 3/20 0.48
MAPT P10636 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
APP P05067 1/20 0.47
NPC1 O15118 2/20 0.47
HPGD P15428 2/20 0.47
TSHR P16473 2/20 0.47
BCHE P06276 1/20 0.47
ACHE P22303 1/20 0.47

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
SCHEMBL12017468 0.84 L3MBTL1 (0.61) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL12017411 0.83 HTT (0.56) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL13209141 0.81 ALDH1A1 (0.72) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL8426765 0.79 HPGD (0.64) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL12988099 0.79 ALDH1A1 (0.52) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL6539266 0.78 KDM4E (0.63) MEN1KMT2AALDH1A1CYP1A2KDM4E
SCHEMBL637604 0.78 KDM4E (0.51) MEN1KMT2ASMN1; SMN2ALDH1A1CYP1A2
SCHEMBL637290 0.78 ALDH1A1 (0.58) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL4203087 0.77 PARP1 (0.64) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL6628627 0.77 POLB (0.50) SMN1; SMN2ALDH1A1CYP1A2POLBL3MBTL1

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-20120220577-A1 GLYCINE B ANTAGONISTS MERZ PHARMA GMBH & CO KGAA 2012-08-30 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-20120220577-A1 GLYCINE B ANTAGONISTS GLRB, GRIN2B, GLRA2 LMNA 1894/4885MEN1 932/4885KMT2A 2708/4885

“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.