SCHEMBL7209663

SCHEMBL7209663

CCNc1c(Cl)c2c(c3ccccc13)Nc1ccc(N(CC)CC)cc1S2

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NOX1 Q9Y5S8 1/20 0.33
KDM1A O60341 1/20 0.31

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
SCHEMBL29912733 0.78 IDO1 (0.33) MAPTMEN1NPC1GAARAB9A
SCHEMBL29565964 0.78 IDO1 (0.33) MAPTMEN1NPC1GAARAB9A
SCHEMBL1133892 0.78 IDO1 (0.33) MAPTMEN1NPC1GAARAB9A
Hydrochloric Acid SCHEMBL20994607 0.78 GAA (0.33) MAPTMEN1NPC1GAARAB9A
Hydrochloric Acid SCHEMBL498746 0.78 GAA (0.33) MAPTMEN1NPC1GAARAB9A
SCHEMBL972682 0.69 SNCA (0.46) MAPTMEN1NPC1GAARAB9A
Hydrochloric Acid SCHEMBL8570840 0.68 TERT (0.31) MAPTGAATDP1
Iodide SCHEMBL3711622 0.68 NOX1 (0.55) MAPTMEN1NPC1GAARAB9A
Iodide SCHEMBL3711621 0.68 NOX1 (0.55) MAPTMEN1NPC1GAARAB9A
Iodide SCHEMBL3711619 0.68 NOX1 (0.55) MAPTMEN1NPC1GAARAB9A

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
EP-0910365-B1 GROWTH INHIBITION AND ERADICATION OF SOLID TUMORS USING A PROLACTIN MODULATOR AND A PHOTOSENSITIZER GEN HOSPITAL CORP (US) 2003-06-25 EP claimed