SCHEMBL13047232

SCHEMBL13047232

COCCn1ccc2c(NC(=O)c3cc(C)c(OC)c(C)c3)cccc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.53
TP53 P04637 2/20 0.51
RAB9A P51151 1/20 0.46
MAPT P10636 1/20 0.46
GRM2 Q14416 5/20 0.45
CNR2 P34972 1/20 0.44
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
TAS1R2 Q8TE23 1/20 0.42
POLB P06746 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL13046874 0.89 GRM2 (0.43) RXFP1TP53RAB9AGRM2TAS1R3
SCHEMBL13047261 0.88 RXFP1 (0.54) RXFP1TP53RAB9AMAPTGRM2
SCHEMBL13047107 0.87 ALDH1A1 (0.43) RXFP1TP53GRM2TAS1R3TAS1R1
SCHEMBL13046705 0.86 RXFP1 (0.52) RXFP1TP53RAB9AMAPTGRM2
SCHEMBL1590846 0.86 TAS1R3 (0.41) RXFP1TP53MAPTGRM2TAS1R3
SCHEMBL13047251 0.86 TP53 (0.56) RXFP1TP53RAB9AMAPTGRM2
SCHEMBL13046974 0.86 ALDH1A1 (0.46) RAB9AMAPTPOLBLMNASMN1; SMN2
SCHEMBL13047509 0.85 RXFP1 (0.55) RXFP1TP53RAB9AMAPTGRM2
SCHEMBL13047234 0.84 RXFP1 (0.52) RXFP1TP53RAB9AMAPTGRM2
SCHEMBL13047824 0.83 ALDH1A1 (0.42) RAB9AMAPTPOLBSMN1; SMN2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546579-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof EVOTEC (US) INC. (US) 2013-10-01 US disclosed
US-8546579-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof EVOTEC (US) INC. (US) 2013-10-01 US disclosed
US-20100292235-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof SECOND GENOME, INC. 2010-11-18 US disclosed
US-20100292235-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof SECOND GENOME, INC. 2010-11-18 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 (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-20100292235-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof P2RX7, P2RX3, P2RX2 RXFP1 1036/4885TP53 4589/4885RAB9A 3422/4885

“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.