SCHEMBL4986763

SCHEMBL4986763

COc1cccc(CN2CCc3[c]nc(C(N)=O)nc3C2)c1OC

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 5/20 0.42
MAPT P10636 2/20 0.40
DRD3 P35462 1/20 0.40
TSHR P16473 1/20 0.40
TACR1 P25103 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL4982815 0.91 MEN1 (0.45) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL4985271 0.87 MEN1 (0.37) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL4986738 0.83 HSP90AB1 (0.45) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL4985162 0.83 KDM4E (0.49) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL4990688 0.82 KDM4E (0.46) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL4988442 0.82 ABCB1 (0.39) MAPT
SCHEMBL4983018 0.82 KMT2A (0.45) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL4988945 0.80 KDM4E (0.40) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL4985028 0.80 KDM4E (0.45) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL4985019 0.80 CA9 (0.40) MEN1KMT2AALDH1A1KDM4EMAPT

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 MEN1 4853/4885KMT2A 4614/4885ALDH1A1 3640/4885

“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.