SCHEMBL13047191

SCHEMBL13047191

CCOc1ccccc1CC(=O)Nc1cccc2c(=O)n(C)ccc12

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.58
POLB P06746 5/20 0.56
LMNA P02545 6/20 0.53
MAPT P10636 2/20 0.50
TP53 P04637 5/20 0.49
THRB P10828 1/20 0.49
RAB9A P51151 1/20 0.48
GAA P10253 2/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL13047164 0.89 MAPT (0.59) TSHRPOLBLMNAMAPTTP53
SCHEMBL13047256 0.86 TP53 (0.62) TSHRPOLBLMNAMAPTTP53
SCHEMBL13046896 0.85 POLB (0.59) TSHRPOLBLMNAMAPTTP53
SCHEMBL13047128 0.85 POLB (0.56) TSHRPOLBLMNAMAPTTP53
SCHEMBL1590410 0.84 TP53 (0.56) TSHRPOLBLMNAMAPTTP53
SCHEMBL13047162 0.83 ALDH1A1 (0.49) POLBLMNAMAPTTP53GAA
SCHEMBL13047022 0.82 POLB (0.56) TSHRPOLBLMNAMAPTTP53
SCHEMBL13047157 0.82 LMNA (0.52) TSHRLMNATP53RAB9AHTT
SCHEMBL15290188 0.81 MAPT (0.48) TSHRPOLBLMNAMAPTTP53
SCHEMBL1591058 0.80 POLB (0.51) TSHRPOLBLMNAMAPTTP53

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 TSHR 3850/4885POLB 3676/4885LMNA 1911/4885

“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.