SCHEMBL4982872

SCHEMBL4982872

CS(=O)(=O)N1CCc2c(N)ncnc2C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
F12 P00748 17/20 0.39
F2 P00734 10/20 0.39
LMNA P02545 1/20 0.37
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36

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
SCHEMBL4985526 0.87 NPC1 (0.40) NPC1RAB9AF12F2
SCHEMBL4988816 0.84 F12 (0.41) F12
SCHEMBL4988828 0.82 TSHR (0.43) NPC1RAB9AF12F2LMNA
SCHEMBL4988452 0.80 MEN1 (0.51) F12F2ESR2
SCHEMBL4991964 0.80 CD4 (0.39) F12
SCHEMBL4988330 0.80 CD4 (0.50) RAB9A
SCHEMBL4985357 0.79 CTSG (0.41) RAB9ALMNA
SCHEMBL4992341 0.77 MET (0.41) LMNA
SCHEMBL4983025 0.77 MEN1 (0.53) LMNA
SCHEMBL4993378 0.77 KMT2A (0.49) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof RENOVIS, INC. 2008-02-14 US claimed
US-7297700-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. (US) 2007-11-20 US claimed

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-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof P2RX7, P2RX3, P2RX2 NPC1 2233/4885RAB9A 3422/4885F12 2899/4885

“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.