SCHEMBL10164980

SCHEMBL10164980

CCOC(=O)/C(=N\NCc1ccccc1)C(=O)c1sccc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
MAPK8 P45983 1/20 0.43
MAPK9 P45984 1/20 0.43
MAPK10 P53779 1/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
KLKB1 P03952 1/20 0.41
KLK1 P06870 1/20 0.41
PKM P14618 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
NFKB1 P19838 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 1/20 0.38
MAPT P10636 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
SCHEMBL10164979 0.76 PKM (0.44) L3MBTL1NPC1RAB9AKMT2AMEN1
SCHEMBL25882415 0.75 MAPT (0.51) KMT2AMEN1SMN1; SMN2HSD17B10ALDH1A1
SCHEMBL8501054 0.74 GSK3B (0.51) L3MBTL1NPC1RAB9AKMT2AMEN1
SCHEMBL12481397 0.73 SMN1; SMN2 (0.49) KMT2AMEN1SMN1; SMN2HSD17B10ALDH1A1
SCHEMBL13212654 0.73 SMN1; SMN2 (0.49) KMT2AMEN1SMN1; SMN2HSD17B10ALDH1A1
SCHEMBL15334000 0.73 SMN1; SMN2 (0.49) KMT2AMEN1SMN1; SMN2HSD17B10ALDH1A1
SCHEMBL13406756 0.72 SMN1; SMN2 (0.48) KMT2AMEN1SMN1; SMN2TSHRHSD17B10
SCHEMBL25882277 0.72 SMN1; SMN2 (0.48) KMT2AMEN1SMN1; SMN2HSD17B10ALDH1A1
SCHEMBL19980197 0.72 MEN1 (0.48) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL19980167 0.71 ALDH1A1 (0.50) RAB9AKMT2AMEN1SMN1; SMN2HSD17B10

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-8293744-B2 Heterocyclic fused cinnoline M1 receptor positive allosteric modulators MERCK SHARP & DOHME CORP. (US) 2012-10-23 US disclosed
US-20120040978-A1 Heterocyclic Fused Cinnoline M1 Receptor Positive Allosteric Modulators MERCK SHARP & DOHME CORP. (US) 2012-02-16 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-20120040978-A1 Heterocyclic Fused Cinnoline M1 Receptor Positive Allosteric Modulators CHRM1, CNR1, CHRNA7 L3MBTL1 3385/4885MAPK8 3827/4885MAPK9 3100/4885

“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.