SCHEMBL4990795

SCHEMBL4990795

CS(=O)(=O)c1nc(N)c2c(n1)CN(S(C)(=O)=O)CC2

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CNR2 P34972 2/20 0.36
F12 P00748 14/20 0.35
F2 P00734 9/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
LMNA P02545 1/20 0.33

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
SCHEMBL4982872 0.75 NPC1 (0.39) NPC1RAB9AF12F2ESR1
SCHEMBL11277506 0.74 SMN1; SMN2 (0.59) SMN1; SMN2L3MBTL1LMNA
SCHEMBL21758675 0.70 NPC1 (0.40) NPC1RAB9ACNR2F12F2
SCHEMBL22492312 0.70 F12 (0.39) NPC1RAB9AF12F2
SCHEMBL2246755 0.68 ESR1 (0.41) NPC1RAB9AESR1ESR2LMNA
SCHEMBL22702980 0.67 F12 (0.37) F12F2ESR1ESR2
SCHEMBL22702917 0.67 F12 (0.46) F12F2
SCHEMBL22702819 0.67 F12 (0.43) F12F2
SCHEMBL11281948 0.63 LMNA (0.44) NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL9099759 0.63 CYP2C19 (0.40) NPC1RAB9ACNR2F12

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 3422/4885CNR2 42/4885

“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.