SCHEMBL6835462

SCHEMBL6835462

O=C1CCCc2ccc(F)cc2C1=NO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.44
PARP10 Q53GL7 1/20 0.44
MAOA P21397 4/20 0.40
MAOB P27338 4/20 0.40
CYP2A6 P11509 1/20 0.40
SRD5A1 P18405 1/20 0.39
PRKCI P41743 1/20 0.39
ACHE P22303 1/20 0.37
NPC1 O15118 4/20 0.37
RAB9A P51151 4/20 0.37
NPY5R Q15761 2/20 0.36
HSD17B1 P14061 1/20 0.36
TP53 P04637 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TYMS P04818 2/20 0.35
CASP3 P42574 2/20 0.35
SENP7 Q9BQF6 2/20 0.35

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
SCHEMBL6835460 1.00 PARP1 (0.44) PARP1PARP10MAOAMAOBCYP2A6
SCHEMBL29446042 0.81 MAOA (0.53) PARP1PARP10MAOAMAOBCYP2A6
SCHEMBL769238 0.81 MAOA (0.53) PARP1PARP10MAOAMAOBCYP2A6
SCHEMBL4017169 0.78 PARP1 (0.53) PARP1PARP10MAOAMAOBCYP2A6
SCHEMBL5469185 0.77 L3MBTL1 (0.53) PARP1PARP10SRD5A1NPC1RAB9A
SCHEMBL9039944 0.77 MAOA (0.63) PARP1PARP10MAOAMAOBCYP2A6
SCHEMBL19754402 0.77 L3MBTL1 (0.53) PARP1PARP10SRD5A1NPC1RAB9A
SCHEMBL5469183 0.77 L3MBTL1 (0.53) PARP1PARP10SRD5A1NPC1RAB9A
SCHEMBL9039952 0.77 MAOA (0.63) PARP1PARP10MAOAMAOBCYP2A6
SCHEMBL6340362 0.73 HPGD (0.58) PARP1PARP10SRD5A1NPY5RCASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009110844-A1 MUSCARINIC RECEPTOR AGONISTS, COMPOSITIONS, METHODS OF TREATMENT THEREOF, AND PROCESSES FOR PREPARATION THEREOF ASTRAZENECA AB (SE) 2009-09-11 WO disclosed
US-20040202495-A1 Imaging apparatus, and toner and process cartridge used in the imaging apparatus RICOH COMPANY, LTD. (JP) 2004-10-14 US disclosed
US-20040198791-A1 Fused imidazole derivative FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-10-07 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-20040198791-A1 Fused imidazole derivative H1-0, H1-5, H1-3 PARP1 3046/4885PARP10 3401/4885MAOA 482/4885

“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.