SCHEMBL5633111

SCHEMBL5633111

CN(C)CC(C)(C)/C=C/c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.44
RELA Q04206 2/20 0.42
GRM5 P41594 1/20 0.42
NPC1 O15118 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAOB P27338 1/20 0.38
KDM4E B2RXH2 2/20 0.36
EGFR P00533 1/20 0.36
CHAT P28329 1/20 0.35
HTR2A P28223 3/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
ALDH1A1 P00352 1/20 0.34
TSHR P16473 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
SCHEMBL5633115 1.00 CYP2C19 (0.44) CYP2C19RELAGRM5NPC1L3MBTL1
SCHEMBL2789093 0.78 CYP2C19 (0.48) CYP2C19RELANPC1L3MBTL1MAOB
SCHEMBL6281994 0.78 CYP2C19 (0.48) CYP2C19RELANPC1L3MBTL1MAOB
SCHEMBL2785212 0.76 CYP2C19 (0.47) CYP2C19RELANPC1L3MBTL1MAOB
SCHEMBL11093287 0.74 CYP2C19 (0.46) CYP2C19RELANPC1L3MBTL1MAOB
SCHEMBL2744182 0.74 CYP2C19 (0.48) CYP2C19RELAGRM5NPC1L3MBTL1
SCHEMBL2744188 0.74 CYP2C19 (0.48) CYP2C19RELAGRM5NPC1L3MBTL1
SCHEMBL28047534 0.73 CYP2C19 (0.49) CYP2C19RELANPC1L3MBTL1MAOB
SCHEMBL6286942 0.72 CYP2C19 (0.55) CYP2C19RELAMAOBEGFRCHAT
SCHEMBL28939716 0.72 CYP2C19 (0.55) CYP2C19RELAMAOBEGFRCHAT

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-7288566-B2 N-hydroxyformamidine derivatives TAISHO PHARMACEUTICAL CO., LTD. (JP) 2007-10-30 US disclosed
US-20060004078-A1 N-hydroxyformamidine derivatives TAISHO PHARMACEUTICAL CO., LTD. (JP) 2006-01-05 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-20060004078-A1 N-hydroxyformamidine derivatives FLT4, FLT1, PGF CYP2C19 52/4885RELA 1342/4885GRM5 2628/4885

“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.