SCHEMBL4229369

SCHEMBL4229369

COc1cc(N)ccc1Oc1ccc(NC(=O)c2ccc(OC34CCCC(CC3)N4C)cc2)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
GAA P10253 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
LMNA P02545 2/20 0.38
PDE4D Q08499 1/20 0.38
MET P08581 3/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 1/20 0.36
MAPT P10636 4/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPK1 P28482 1/20 0.36
HPGD P15428 1/20 0.36
KIT P10721 1/20 0.36
PDGFRA P16234 1/20 0.36

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
SCHEMBL4236537 0.88 MAPT (0.44) CYP1A2CYP3A4CYP2C19GAAMAPT
SCHEMBL4226989 0.84 TAS1R3 (0.39) CYP1A2CYP3A4CYP2C19GAASMN1; SMN2
SCHEMBL4232271 0.79 MCHR1 (0.38) METTP53KMT2A
SCHEMBL13699114 0.79 CYP2D6 (0.45) CYP1A2CYP3A4CYP2C19GAASMN1; SMN2
SCHEMBL4228728 0.77 PKM (0.38) GAASMN1; SMN2NPC1RAB9AMET
SCHEMBL4228368 0.76 LPAR1 (0.39)
SCHEMBL4787541 0.76 MCHR1 (0.36) TAS1R3TAS1R1MAPTKDR
SCHEMBL4228886 0.75 PKM (0.40) LMNAMETTAS1R3TAS1R1MAPT
SCHEMBL4236608 0.74 FGFR1 (0.46) CYP1A2CYP3A4CYP2C19GAASMN1; SMN2
SCHEMBL4229247 0.74 MCHR1 (0.45) SMN1; SMN2NPC1RAB9ATAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R CYP1A2 1202/4885CYP3A4 2140/4885CYP2C19 733/4885

“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.