SCHEMBL3320697

SCHEMBL3320697

CC(C)(CC(=O)N1CCN(Cc2ccc3ccccc3c2)CC1)C(N)=O

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.60
MC5R P33032 1/20 0.60
FAAH O00519 3/20 0.55
DPP8 Q6V1X1 1/20 0.54
KMT2A Q03164 4/20 0.54
MEN1 O00255 3/20 0.54
PKM P14618 1/20 0.51
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
MGLL Q99685 1/20 0.49
NPC1 O15118 1/20 0.49
CHKA P35790 1/20 0.49

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
SCHEMBL6135913 0.85 LMNA (0.56) KMT2AMEN1ALDH1A1LMNA
SCHEMBL3318521 0.83 FAAH (0.54) FAAHKMT2AMEN1ALDH1A1LMNA
SCHEMBL3320695 0.81 MC4R (0.59) MC4RMC5RFAAHDPP8KMT2A
SCHEMBL3319753 0.79 FAAH (0.56) FAAHALDH1A1
SCHEMBL18872548 0.78 ALDH1A1 (0.65) MC4RMC5RFAAHDPP8KMT2A
SCHEMBL3320543 0.78 FAAH (0.52) FAAHDPP8KMT2AMEN1ALDH1A1
SCHEMBL16855862 0.77 FAAH (0.58) MC4RMC5RFAAHKMT2AMEN1
SCHEMBL17276352 0.77 FAAH (0.58) MC4RMC5RFAAHKMT2AMEN1
SCHEMBL3602106 0.77 KMT2A (0.71) MC4RMC5RFAAHKMT2AMEN1
SCHEMBL3315587 0.77 KDM4E (0.61) ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100125075-A1 Antibacterial Agents BRITISH BIOTECH PHARMACEUTICALS LTD. (GB) 2010-05-20 US disclosed
US-7186719-B2 Antibacterial agents BRITISH BIOTECH PHARMACEUTICALS (GB) 2007-03-06 US disclosed
US-20050065095-A1 Antibacterial agents BRITISH BIOTECH PHARMACEUTICALS LTD. (GB) 2005-03-24 US disclosed
US-6846825-B1 Antibacterial agents BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2005-01-25 US disclosed
EP-1202968-A2 ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2002-05-08 EP disclosed
WO-2001010834-A9 ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARM (GB) 2001-08-09 WO disclosed
WO-2001010834-A2 ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2001-02-15 WO 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 (2 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-20050065095-A1 Antibacterial agents NQO2, DAO, Q6ZSR9 MC4R 4162/4885MC5R 3926/4885FAAH 1160/4885
US-20100125075-A1 Antibacterial Agents NQO2, DAO, Q6ZSR9 MC4R 4146/4885MC5R 4021/4885FAAH 1166/4885

“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.