SCHEMBL4867572

SCHEMBL4867572

CC(=S)NCc1ccc(F)cc1

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 2/20 0.70
ATG4B Q9Y4P1 2/20 0.70
MAOB P27338 2/20 0.54
POLB P06746 1/20 0.53
LMNA P02545 2/20 0.52
KMT2A Q03164 3/20 0.51
HPGD P15428 2/20 0.51
MEN1 O00255 2/20 0.51
GAA P10253 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MAOA P21397 1/20 0.51
ATM Q13315 1/20 0.51
ALDH1A1 P00352 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL16870888 0.81 PTPN7 (0.47) PLA2G1BATG4BPOLBLMNAKMT2A
SCHEMBL15100298 0.81 SMN1; SMN2 (0.53) POLBLMNAKMT2AHPGDMEN1
SCHEMBL20496874 0.80 PLA2G1B (0.78) PLA2G1BATG4BMAOBPOLBLMNA
SCHEMBL6621549 0.80 PLA2G1B (0.66) PLA2G1BATG4BMAOBPOLBLMNA
SCHEMBL2530016 0.79 KMT2A (0.63) PLA2G1BATG4BMAOBPOLBLMNA
SCHEMBL16216177 0.79 PLA2G1B (0.59) PLA2G1BATG4BMAOBPOLBLMNA
SCHEMBL1959781 0.79 PLA2G1B (0.70) PLA2G1BATG4BMAOBPOLBLMNA
SCHEMBL12657500 0.79 PLA2G1B (0.59) PLA2G1BATG4BMAOBLMNAKMT2A
SCHEMBL2451899 0.78 ALOX12 (0.68) PLA2G1BATG4BMAOBPOLBLMNA
SCHEMBL4872149 0.77 PTPN7 (0.53) PLA2G1BATG4BPOLBLMNAKMT2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1436249-B1 MUSCARINIC AGONISTS LILLY CO ELI (US) 2013-11-06 EP disclosed
US-7326731-B2 Muscarinic agonists ELI LILLY AND COMPANY (US) 2008-02-05 US disclosed
CN-1556788-A Muscarinic agonists 2004-12-22 CN disclosed
US-20040242584-A1 exemplified by Biphenyl-4-carboxylic acid (R)-(6-(1-((4-fluorobenzyl)methylamino)ethylideneamino) 2(R)-hydroxyindan-1-yl)amide; treating cognitive impairment associated with schizophrenia or Alzheimer's disease ELI LILLY AND COMPANY 2004-12-02 US disclosed
EP-1436249-A2 MUSCARINIC AGONISTS ELI LILLY AND COMPANY (US) 2004-07-14 EP disclosed
WO-2003027061-A2 MUSCARINIC AGONISTS ELI LILLY AND COMPANY (US) 2003-04-03 WO 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-20040242584-A1 exemplified by Biphenyl-4-carboxylic acid (R)-(6-(1-((4-fluorobenzyl)methylamino)ethylideneamino) 2(R)-hydroxyindan-1-yl)amide; treating cognitive impairment associated with schizophrenia or Alzheimer's disease CHRM1, CHRM2, CHRM4 PLA2G1B 1758/4885ATG4B 4107/4885MAOB 322/4885

“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.