SCHEMBL6733385

SCHEMBL6733385

O=C(C1CC1)N(Cc1cccnc1)c1ccc(Oc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.47
FAAH O00519 2/20 0.47
UBE2M P61081 4/20 0.47
DCUN1D1 Q96GG9 4/20 0.47
TP53 P04637 3/20 0.44
MAPT P10636 2/20 0.44
SERPINE1 P05121 1/20 0.43
GRM2 Q14416 2/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL6731406 0.86 GRM2 (0.55) CYP3A4TP53MAPTGRM2
SCHEMBL6730763 0.83 CYP3A4 (0.59) CYP3A4TP53MAPTGRM2
SCHEMBL6730973 0.83 MAPT (0.51) CYP3A4FAAHTP53MAPTGRM2
SCHEMBL6733035 0.82 MAPT (0.54) CYP3A4TP53MAPTGRM2
SCHEMBL6739041 0.81 CYP3A4 (0.50) CYP3A4TP53MAPTGRM2
SCHEMBL6735554 0.81 NPC1 (0.48) CYP3A4TP53MAPTGRM2
SCHEMBL6728076 0.81 CYP3A4 (0.49) CYP3A4UBE2MDCUN1D1TP53MAPT
SCHEMBL7419432 0.81 CYP3A4 (0.49) CYP3A4TP53MAPTGRM2
SCHEMBL6730921 0.80 NR1H4 (0.46) CYP3A4TP53MAPT
SCHEMBL6727717 0.80 CYP19A1 (0.48) CYP3A4TP53MAPTGRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040006114-A1 Potentiators of glutamate receptors ELI LILLY AND COMPANY 2004-01-08 US claimed
EP-1255735-A2 PYRIDINE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2002-11-13 EP claimed
WO-2001056990-A2 PYRIDINE DERIVATES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2001-08-09 WO 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-20040006114-A1 Potentiators of glutamate receptors GRM1, GRIN1, GRM2 CYP3A4 2786/4885FAAH 894/4885UBE2M 4173/4885

“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.