SCHEMBL5535397

SCHEMBL5535397

O=c1c2c(-c3ccccc3)noc2cc(-c2ccccc2)n1C1CC1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.68
RAB9A P51151 6/20 0.68
CASP3 P42574 1/20 0.68
SENP8 Q96LD8 1/20 0.68
SENP7 Q9BQF6 1/20 0.68
SENP6 Q9GZR1 1/20 0.68
NR4A2 P43354 4/20 0.61
MITF O75030 1/20 0.61
DCTPP1 Q9H773 3/20 0.55
TSHR P16473 1/20 0.55

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
SCHEMBL5538903 0.87 NR4A2 (0.76) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL3663640 0.81 NPC1 (1.00) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL5532304 0.79 NPC1 (0.95) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL6069179 0.76 NR4A2 (1.00) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL11409495 0.76 NPC1 (1.00) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL2482092 0.76 NPC1 (1.00) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL2482452 0.76 NR4A2 (1.00) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL5538618 0.75 NPC1 (0.70) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL11420874 0.75 NPC1 (0.85) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL11406007 0.75 NPC1 (0.85) NPC1RAB9ACASP3SENP8SENP7

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-1418912-B1 ISOXAZOLOPYRIDINONES NOVARTIS AG (CH) 2007-02-28 EP claimed
EP-1418912-B1 ISOXAZOLOPYRIDINONES NOVARTIS AG (CH) 2007-02-28 EP disclosed
US-7087756-B2 Isoxazolopyridinones NOVARTIS AG (CH) 2006-08-08 US disclosed
US-20040248893-A1 Isoxazolopyridinones NOVARTIS AG (CH) 2004-12-09 US disclosed
EP-1418912-A2 ISOXAZOLOPYRIDINONES Novartis AG (CH) 2004-05-19 EP disclosed
WO-2003015780-A2 ISOXAZOLOPYRIDINONES AND USE THEREOF IN THE TREATMENT OF PARKINSON'S DISEASE NOVARTIS AG (CH) 2003-02-27 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-20040248893-A1 Isoxazolopyridinones XDH, NPY1R, TBXA2R NPC1 3047/4885RAB9A 2041/4885CASP3 3363/4885

“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.