SCHEMBL4237948

SCHEMBL4237948

CCC(CC)NC(=O)Nc1ccc(Oc2ccc(N(CC(F)(F)F)C(=O)c3ccc(OC45CCCC(CC4)N5C)cc3)cc2)c(OC)c1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.34
PKM P14618 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
LPAR1 Q92633 3/20 0.33
LPAR5 Q9H1C0 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PDGFRA P16234 1/20 0.31
EPHX2 P34913 1/20 0.31
MAPT P10636 3/20 0.31
FGFR1 P11362 1/20 0.31
ALDH1A1 P00352 1/20 0.30
MEN1 O00255 2/20 0.30
GAA P10253 2/20 0.30
KMT2A Q03164 2/20 0.30
POLB P06746 1/20 0.30
HTT P42858 1/20 0.30
RAF1 P04049 1/20 0.30

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
SCHEMBL4241978 0.93 PKM (0.36) MCHR1PKMTAS1R3TAS1R1LPAR1
SCHEMBL4233732 0.92 MCHR1 (0.35) MCHR1PKMTAS1R3TAS1R1LPAR1
SCHEMBL4242456 0.90 PKM (0.37) MCHR1PKMTAS1R3TAS1R1LPAR1
SCHEMBL4228160 0.87 MCHR1 (0.34) MCHR1PKMTAS1R3TAS1R1LPAR1
SCHEMBL4239122 0.87 PKM (0.33) MCHR1PKMTAS1R3TAS1R1LPAR1
SCHEMBL4229247 0.86 MCHR1 (0.45) MCHR1PKMTAS1R3TAS1R1SMN1; SMN2
SCHEMBL4231908 0.85 ALDH1A1 (0.34) PKMTAS1R3TAS1R1NPSR1EPHX2
SCHEMBL13699295 0.83 CYP2D6 (0.37) MCHR1PKMTAS1R3TAS1R1LPAR1
SCHEMBL4238808 0.83 MCHR1 (0.42) MCHR1PKMTAS1R3TAS1R1SMN1; SMN2
SCHEMBL4226989 0.82 TAS1R3 (0.39) MCHR1PKMTAS1R3TAS1R1SMN1; SMN2

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
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP claimed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 WO claimed
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 MCHR1 47/4885PKM 1734/4885TAS1R3 1436/4885

“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.