SCHEMBL5447485

SCHEMBL5447485

N#CCOc1ccc2cc(-c3ccc(-c4ccccc4)[nH]3)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.38
MAOA P21397 3/20 0.38
MAPT P10636 3/20 0.38
KMT2A Q03164 3/20 0.38
KDM4E B2RXH2 3/20 0.38
MEN1 O00255 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
ALOX5 P09917 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PGR P06401 1/20 0.36
CYP19A1 P11511 2/20 0.35
AGXT P21549 1/20 0.35
PTPN7 P35236 1/20 0.35
GLA P06280 1/20 0.35
L3MBTL1 Q9Y468 1/20 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
SCHEMBL17266914 0.78 RAB9A (0.47) MAPTKMT2AKDM4EMEN1NPC1
SCHEMBL11026671 0.77 AGXT (0.57) MAPTKMT2AKDM4EMEN1NPC1
SCHEMBL5451110 0.76 NPC1 (0.62) MAPTKMT2AKDM4EMEN1NPC1
SCHEMBL5457662 0.76 PSEN1 (0.40) MAOBMAOAKMT2AMEN1NPC1
SCHEMBL9782182 0.75 MAOB (0.46) MAOBMAOAMAPTKDM4ENPC1
SCHEMBL5448815 0.75 ADORA2A (0.39) MAOBMAOAMAPTKMT2ACYP11B1
SCHEMBL5450050 0.75 NPC1 (0.41) MAPTKMT2AKDM4EMEN1NPC1
SCHEMBL2945132 0.73 TSHR (0.52) MAPTKMT2AKDM4EMEN1NPC1
SCHEMBL4269954 0.73 CDC25A (0.59) MAPTKMT2AKDM4EMEN1NPC1
SCHEMBL5451162 0.73 PGR (0.46) MAPTKDM4ENPSR1ALOX5ALDH1A1

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
US-20070123495-A1 PYRROLO-NAPHTHYL ACIDS AND METHODS FOR USING THEM WYETH (US) 2007-05-31 US disclosed
US-7186749-B2 Pyrrolo-naphthyl acids and methods for using them WYETH (US) 2007-03-06 US disclosed
US-20060052349-A1 Pyrrolo-naphthyl acids and methods for using them WYETH (US) 2006-03-09 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 (2 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-20070123495-A1 PYRROLO-NAPHTHYL ACIDS AND METHODS FOR USING THEM SERPINE1, SERPINC1, SERPINB1 MAOB 375/4885MAOA 475/4885MAPT 4329/4885
US-20060052349-A1 Pyrrolo-naphthyl acids and methods for using them SERPINE1, SERPINC1, SERPINB1 MAOB 375/4885MAOA 475/4885MAPT 4329/4885

“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.