SCHEMBL1590128

SCHEMBL1590128

CC(C(=O)Nc1cccc2c(=O)n([C@H](CO[Si](C)(C)C(C)(C)C)C(N)=O)ccc12)c1ccc(Cl)cc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 8/20 0.37
MAPT P10636 2/20 0.35
TP53 P04637 1/20 0.35
NR3C2 P08235 1/20 0.33
ACKR3 P25106 1/20 0.33
FFAR2 O15552 1/20 0.32
SHMT2 P34897 1/20 0.32
PTGES O14684 1/20 0.32
GPR139 Q6DWJ6 2/20 0.32
KMT2A Q03164 1/20 0.32
USP30 Q70CQ3 1/20 0.31

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
SCHEMBL1591142 0.93 P2RX7 (0.39) P2RX7MAPTTP53NR3C2ACKR3
SCHEMBL13135963 0.92 NR3C2 (0.38) P2RX7MAPTTP53NR3C2ACKR3
SCHEMBL1591144 0.87 P2RX7 (0.39) P2RX7
SCHEMBL1589917 0.85 P2RX7 (0.41) P2RX7PTGESGPR139
SCHEMBL1590087 0.84 P2RX7 (0.43) P2RX7MAPTTP53NR3C2FFAR2
SCHEMBL1590085 0.84 P2RX7 (0.43) P2RX7MAPTTP53NR3C2FFAR2
SCHEMBL12702865 0.84 MAPT (0.40) P2RX7MAPTTP53NR3C2FFAR2
SCHEMBL1590582 0.83 P2RX7 (0.40) P2RX7NR3C2SHMT2GPR139
SCHEMBL1590581 0.83 P2RX7 (0.40) P2RX7NR3C2SHMT2GPR139
SCHEMBL1590573 0.83 P2RX7 (0.40) P2RX7GPR139

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1933622-B1 BICYCLOHETEROARYL COMPOUNDS AS P2X7 MODULATORS AND USES THEREOF SECOND GENOME INC (US) 2016-03-09 EP disclosed
US-20110092476-A1 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. 2011-04-21 US disclosed
US-7816371-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. (US) 2010-10-19 US disclosed
US-7816371-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. (US) 2010-10-19 US disclosed
US-7816371-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. (US) 2010-10-19 US disclosed
US-20070225324-A1 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof SECOND GENOME, INC. 2007-09-27 US disclosed
US-20070225324-A1 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof SECOND GENOME, INC. 2007-09-27 US disclosed
US-20070225324-A1 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof SECOND GENOME, INC. 2007-09-27 US 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 (2 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-20070225324-A1 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof P2RX7, P2RX3, P2RX2 P2RX7 1/4885MAPT 4477/4885TP53 4589/4885
US-20110092476-A1 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof P2RX7, P2RX3, P2RX2 P2RX7 1/4885MAPT 4477/4885TP53 4589/4885

“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.