SCHEMBL3024467

SCHEMBL3024467

c1ccc(COc2ccc3c(c2)C2CN(Cc4ccccc4)CC2OC3)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR5 Q9H228 3/20 0.47
NPC1 O15118 3/20 0.44
RAB9A P51151 2/20 0.44
TP53 P04637 2/20 0.44
DRD2 P14416 3/20 0.44
DRD3 P35462 3/20 0.44
S1PR1 P21453 2/20 0.44
PRKX P51817 1/20 0.44
ACVR1 Q04771 1/20 0.44
MAOA P21397 3/20 0.44
MAOB P27338 3/20 0.44
GRIN1 Q05586 2/20 0.43
GRIN2B Q13224 2/20 0.43
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
HRH3 Q9Y5N1 3/20 0.42
CYP2D6 P10635 1/20 0.42
HRH1 P35367 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42

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
SCHEMBL3024572 1.00 S1PR5 (0.47) S1PR5NPC1RAB9ATP53DRD2
SCHEMBL3024468 1.00 S1PR5 (0.47) S1PR5NPC1RAB9ATP53DRD2
SCHEMBL3024463 1.00 S1PR5 (0.47) S1PR5NPC1RAB9ATP53DRD2
SCHEMBL3024576 1.00 S1PR5 (0.47) S1PR5NPC1RAB9ATP53DRD2
SCHEMBL3018337 0.91 GRIN1 (0.48) S1PR5NPC1RAB9ATP53DRD2
SCHEMBL3018340 0.91 GRIN1 (0.48) S1PR5NPC1RAB9ATP53DRD2
SCHEMBL3018338 0.91 GRIN1 (0.48) S1PR5NPC1RAB9ATP53DRD2
SCHEMBL3027871 0.82 DRD2 (0.55) DRD2DRD3CYP2D6
SCHEMBL3027874 0.82 DRD2 (0.55) DRD2DRD3CYP2D6
SCHEMBL3027868 0.82 DRD2 (0.55) DRD2DRD3CYP2D6

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-20100210680-A1 TRICYCLIC HETEROCYCLIC DERIVATIVES N.V. ORGANON 2010-08-19 US disclosed
EP-2203454-A1 TRICYCLIC HETEROCYCLIC DERIVATIVES N.V. Organon (NL) 2010-07-07 EP disclosed
WO-2009037220-A1 TRICYCLIC HETEROCYCLIC DERIVATIVES N.V. ORGANON (NL) 2009-03-26 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-20100210680-A1 TRICYCLIC HETEROCYCLIC DERIVATIVES TPH1, HTR2C, TPH2 S1PR5 1546/4885NPC1 954/4885RAB9A 2929/4885

“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.