SCHEMBL2794791

SCHEMBL2794791

N#Cc1cccc2oc(CI)nc12

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 1/20 0.34
HTT P42858 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
GRM2 Q14416 1/20 0.32
CYP2A6 P11509 1/20 0.32
RORC P51449 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
NISCH Q9Y2I1 1/20 0.31
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL12778286 0.78 PSMB8 (0.37) PSMB8HTTRAB9AGRM2CYP2A6
SCHEMBL31119206 0.76 PSMB8 (0.38) PSMB8HTTMAPTCYP2A6CA1
SCHEMBL1280127 0.75 PSMB8 (0.37) PSMB8HTTMAPTCYP2A6CA1
SCHEMBL31109647 0.75 ELANE (0.41) PSMB8HTTMAPTGRM2CYP2A6
SCHEMBL1281032 0.75 PSMB8 (0.37) PSMB8HTTGRM2CYP2A6RORC
SCHEMBL3262100 0.74 PSMB8 (0.41) PSMB8HTTNPC1MAPTRAB9A
SCHEMBL2794960 0.72 HRH4 (0.36) NPC1MAPTRAB9AGRM2
SCHEMBL14327805 0.71 MAPT (0.38) PSMB8HTTNPC1MAPTRAB9A
SCHEMBL2791481 0.71 F2RL3 (0.42) PSMB8NPC1MAPTRAB9ACYP2A6
SCHEMBL13240830 0.71 NPC1 (0.33) NPC1MAPTRAB9ALMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168167-A1 Piperidinones Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2010-07-01 US disclosed
WO-2010029299-A1 PYRIMIDINONE DERIVATIES FOR USE AS MEDICAMENTS BIOLIPOX AB (SE) 2010-03-18 WO disclosed
EP-2134686-A1 PIPERIDINONES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2009-12-23 EP disclosed
WO-2008110793-A1 PIPERIDINONES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-09-18 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-20100168167-A1 Piperidinones Useful in the Treatment of Inflammation ARG1, ARG2, PRMT1 PSMB8 3657/4885HTT 2575/4885NPC1 2774/4885

“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.