SCHEMBL1590601

SCHEMBL1590601

CC(C(=O)Nc1cccc2c(=O)n(C(C(N)=O)c3ccc(Cl)cc3)ccc12)c1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 1/20 0.41
MAPT P10636 3/20 0.40
TP53 P04637 1/20 0.40
P2RX7 Q99572 8/20 0.40
KMT2A Q03164 1/20 0.38
FFAR2 O15552 1/20 0.37
KCNQ2 O43526 1/20 0.35
CRHBP P24387 1/20 0.35
RAB9A P51151 1/20 0.35
CRHR2 Q13324 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TRPV1 Q8NER1 1/20 0.34
PARP1 P09874 1/20 0.34
SHMT2 P34897 1/20 0.34
LMNA P02545 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL1590598 1.00 NR3C2 (0.41) NR3C2MAPTTP53P2RX7KMT2A
SCHEMBL1590553 1.00 NR3C2 (0.41) NR3C2MAPTTP53P2RX7KMT2A
SCHEMBL1589988 0.97 MAPT (0.40) NR3C2MAPTTP53P2RX7KMT2A
SCHEMBL27744085 0.97 MAPT (0.40) NR3C2MAPTTP53P2RX7KMT2A
SCHEMBL27744084 0.97 MAPT (0.40) NR3C2MAPTTP53P2RX7KMT2A
SCHEMBL1589984 0.97 MAPT (0.40) NR3C2MAPTTP53P2RX7KMT2A
SCHEMBL1589986 0.97 MAPT (0.40) NR3C2MAPTTP53P2RX7KMT2A
SCHEMBL1590376 0.91 P2RX7 (0.42) NR3C2MAPTTP53P2RX7KMT2A
SCHEMBL1590509 0.91 P2RX7 (0.42) NR3C2MAPTTP53P2RX7KMT2A
SCHEMBL1590380 0.91 P2RX7 (0.42) NR3C2MAPTTP53P2RX7KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110092476-A1 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. 2011-04-21 US claimed
US-7816371-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. (US) 2010-10-19 US claimed
US-20070225324-A1 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof SECOND GENOME, INC. 2007-09-27 US claimed
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-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 NR3C2 432/4885MAPT 4477/4885TP53 4589/4885
US-20110092476-A1 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof P2RX7, P2RX3, P2RX2 NR3C2 432/4885MAPT 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.