SCHEMBL6540450

SCHEMBL6540450

CC(N)C[N+]1C(=O)c2ccccc2C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.38
SLC6A2 P23975 2/20 0.38
TAAR1 Q96RJ0 2/20 0.38
ADORA2A P29274 2/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
CYP2A6 P11509 1/20 0.38
ADORA1 P30542 1/20 0.38
CDC25B P30305 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 3/20 0.36
RAB9A P51151 3/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
BLM P54132 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
APAF1 O14727 2/20 0.36

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
SCHEMBL10700506 0.72 KMT2A (0.39) MAOACDC25BMEN1KMT2APOLB
SCHEMBL7342245 0.72 CDC25B (0.39) MAOACDC25BMEN1KMT2APOLB
Anthraquinone SCHEMBL28433800 0.68 CDC25B (0.71) MAOAADORA2ACDC25BMEN1KMT2A
SCHEMBL9065440 0.67 MEN1 (0.39) MAOACDC25BMEN1KMT2APOLB
Naphthoquinone SCHEMBL28565535 0.65 IDO1 (0.58) MAOASLC6A2TAAR1ADORA2ASLC6A4
SCHEMBL3379010 0.64 ELANE (0.51) KMT2ARAB9ANPC1MAPK1TDP1
SCHEMBL6540452 0.64 ELANE (0.51) KMT2ARAB9ANPC1MAPK1TDP1
SCHEMBL1530702 0.64 ELANE (0.51) KMT2ARAB9ANPC1MAPK1TDP1
SCHEMBL4394784 0.64 TAAR1 (0.38) SLC6A2TAAR1SLC6A4SLC6A3SIGMAR1
SCHEMBL1412991 0.64 S100A4 (0.39) MAOACDC25BMEN1KMT2APOLB

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-20040110229-A1 Muscarinic receptor antagonists PNC BANK, NATIONAL ASSOCIATION 2004-06-10 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-20040110229-A1 Muscarinic receptor antagonists CHRM3, CHRM5, CHRM2 MAOA 418/4885SLC6A2 2407/4885TAAR1 149/4885

“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.