SCHEMBL2822307

SCHEMBL2822307

CCOC(=O)c1c(/C=C/c2cccc(OC)c2OC2CCCC2)nc2sccn12

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.45
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 4/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
KMT2A Q03164 4/20 0.36
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NFE2L2 Q16236 1/20 0.35
RXFP1 Q9HBX9 1/20 0.34
TSHR P16473 1/20 0.34
TP53 P04637 1/20 0.34
PDE4B Q07343 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
SCHEMBL2822310 1.00 MAPK1 (0.45) MAPK1KDM4EALDH1A1L3MBTL1KMT2A
SCHEMBL2823947 0.91 MAPK1 (0.42) MAPK1KDM4EALDH1A1KMT2AMEN1
SCHEMBL2823943 0.91 MAPK1 (0.42) MAPK1KDM4EALDH1A1KMT2AMEN1
SCHEMBL2827292 0.89 TRPM8 (0.38) MAPK1KDM4EALDH1A1L3MBTL1KMT2A
SCHEMBL2827290 0.89 TRPM8 (0.38) MAPK1KDM4EALDH1A1L3MBTL1KMT2A
SCHEMBL2825383 0.87 MAPK1 (0.45) MAPK1KDM4EALDH1A1L3MBTL1KMT2A
SCHEMBL2825379 0.87 MAPK1 (0.45) MAPK1KDM4EALDH1A1L3MBTL1KMT2A
SCHEMBL2826904 0.83 MAPK1 (0.46) MAPK1KDM4EALDH1A1L3MBTL1KMT2A
SCHEMBL2826906 0.83 MAPK1 (0.46) MAPK1KDM4EALDH1A1L3MBTL1KMT2A
SCHEMBL2823984 0.83 MAPK1 (0.46) MAPK1KDM4EALDH1A1L3MBTL1KMT2A

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-8318928-B2 Fused imidazole carboxamides as TRPV3 modulators GLENMARK PHARMACEUTICALS, S.A. (CH) 2012-11-27 US disclosed
US-20100152192-A1 FUSED IMIDAZOLE CARBOXAMIDES AS TRPV3 MODULATORS GLENMARK PHARMACEUTICALS S.A (CH) 2010-06-17 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-20100152192-A1 FUSED IMIDAZOLE CARBOXAMIDES AS TRPV3 MODULATORS TRPV3, TRPV1, TRPV2 MAPK1 2141/4885KDM4E 3190/4885ALDH1A1 2705/4885

“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.