SCHEMBL4992079

SCHEMBL4992079

COc1ccc(S(=O)(=O)N2CCc3c(N)ncnc3C2)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.58
CYP2C19 P33261 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
GPBAR1 Q8TDU6 1/20 0.51
HSD17B10 Q99714 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
TSHR P16473 2/20 0.47
LMNA P02545 2/20 0.47
USP2 O75604 1/20 0.47
GLA P06280 1/20 0.47
MAPK1 P28482 1/20 0.47
HTR6 P50406 2/20 0.47
POLB P06746 1/20 0.47
HTT P42858 1/20 0.47
PKM P14618 4/20 0.46
PDE4A P27815 1/20 0.45
PDE4B Q07343 1/20 0.45
PDE4C Q08493 1/20 0.45

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
SCHEMBL4987016 0.85 PKM (0.51) SMN1; SMN2KDM4EALDH1A1TSHRLMNA
SCHEMBL4988177 0.85 MKNK1 (0.47) ALDH1A1TSHRLMNAMAPK1HTR6
SCHEMBL4985509 0.83 KMT2A (0.56) HSD17B10KDM4EALDH1A1TSHRLMNA
SCHEMBL4982944 0.83 KMT2A (0.53) SMN1; SMN2KDM4EALDH1A1TSHRLMNA
SCHEMBL4983071 0.83 PKM (0.48) SMN1; SMN2KDM4EALDH1A1TSHRLMNA
SCHEMBL4988330 0.82 CD4 (0.50) ALDH1A1POLBHTTPKMHSD11B1
SCHEMBL4988645 0.81 MAPT (0.42) SMN1; SMN2KDM4EALDH1A1TSHRLMNA
SCHEMBL4986180 0.81 MCOLN3 (0.50) SMN1; SMN2KDM4ETSHRLMNAHTT
SCHEMBL4992497 0.81 MAPK1 (0.44) SMN1; SMN2KDM4EALDH1A1MAPK1PKM
SCHEMBL4988452 0.80 MEN1 (0.51) CYP3A4CYP2C19SMN1; SMN2ALDH1A1MAPK1

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 1 patent. 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

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 CYP3A4 1221/4885CYP2C19 1078/4885SMN1; SMN2 4369/4885

“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.