SCHEMBL4982902

SCHEMBL4982902

CCCCN1CCc2c(N)ncnc2C1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
KDR P35968 5/20 0.39
ADORA2B P29275 1/20 0.38
ADORA1 P30542 1/20 0.38
HTR1A P08908 1/20 0.37
GRM5 P41594 1/20 0.37
DRD2 P14416 2/20 0.36
DRD3 P35462 2/20 0.36
ALDH1A1 P00352 1/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
ABCB1 P08183 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
SCHEMBL4988741 0.96 KDR (0.44) LMNATP53MAPTRXFP1KDR
SCHEMBL4985387 0.91 DRD2 (0.43) ADORA2ALMNAMAPTRXFP1KDR
SCHEMBL4989502 0.85 RAD52 (0.42) ADORA2ALMNAMAPTADORA1ALDH1A1
SCHEMBL4985157 0.82 GRIA1 (0.39) GRM5DRD2DRD3SIGMAR1
SCHEMBL4988540 0.80 SIGMAR1 (0.48) SIGMAR1
SCHEMBL4989114 0.79 COMT (0.35) ADORA2AADORA2BADORA1
SCHEMBL4986063 0.79 LIMK1 (0.32) ADORA2AKDRADORA2BADORA1
SCHEMBL4986780 0.78 PI4KA (0.39) TP53SIGMAR1
SCHEMBL4991248 0.76 GNRHR (0.36) SIGMAR1
SCHEMBL4983874 0.75 PIK3CA (0.36)

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 ADORA2A 18/4885LMNA 1911/4885TP53 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.