SCHEMBL4238103

SCHEMBL4238103

CCC(CC)NC(=O)Nc1ccc(Oc2ccc(CC(C)(C)OC(N)=O)cc2)c(C(=O)NC)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
PTGDR2 Q9Y5Y4 5/20 0.36
S1PR1 P21453 1/20 0.35
PPARG P37231 2/20 0.34
PPARD Q03181 2/20 0.34
PPARA Q07869 2/20 0.34
HDAC3 O15379 1/20 0.34
BRAF P15056 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 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
SCHEMBL4227148 0.86 PKM (0.49) PKMTAS1R3TAS1R1ALDH1A1
SCHEMBL4237333 0.85 PKM (0.50) PKMTAS1R3TAS1R1HDAC3BRAF
SCHEMBL4233396 0.85 PKM (0.52) PKMTAS1R3TAS1R1
SCHEMBL4242067 0.83 PKM (0.48) PKMTAS1R3TAS1R1HDAC3BRAF
SCHEMBL4233830 0.83 PKM (0.45) PKMTAS1R3TAS1R1S1PR1BRAF
SCHEMBL4236321 0.82 PKM (0.47) PKMTAS1R3TAS1R1PPARACTSK
SCHEMBL4686268 0.81 PKM (0.53) PKMTAS1R3TAS1R1PPARGPPARD
SCHEMBL4236993 0.81 PKM (0.51) PKMALDH1A1CYP2C9CYP2C19
SCHEMBL4228409 0.78 PKM (0.45) PKMTAS1R3TAS1R1CTSKCYP2C9
SCHEMBL5149824 0.77 PKM (0.49) PKMTAS1R3TAS1R1PPARGBRAF

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 PKM 1734/4885TAS1R3 1436/4885TAS1R1 1073/4885

“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.