SCHEMBL4236281

SCHEMBL4236281

CCCCN1CCC(Oc2ccc(C(=O)Nc3ccc(Oc4ccc(NC(=O)NC(CC)CC)cc4)cc3OC)cc2C)CC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.45
TAS1R1 Q7RTX1 2/20 0.45
MCHR1 Q99705 6/20 0.40
PKM P14618 1/20 0.40
HTR4 Q13639 1/20 0.40
NAMPT P43490 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SLC5A7 Q9GZV3 1/20 0.38
MCHR2 Q969V1 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL4236472 0.93 HRH3 (0.41) TAS1R3TAS1R1MCHR1PKMHTR4
SCHEMBL4229188 0.92 MCHR1 (0.40) MCHR1PKMMAPTMEN1KMT2A
SCHEMBL4233219 0.91 SMN1; SMN2 (0.44) MCHR1PKMHTR4SMN1; SMN2NPSR1
SCHEMBL4233470 0.90 MCHR1 (0.40) TAS1R3TAS1R1MCHR1PKMMAPT
SCHEMBL4540719 0.89 MCHR1 (0.44) MCHR1HTR4SLC5A7MCHR2ALDH1A1
SCHEMBL4238135 0.89 SMN1; SMN2 (0.41) TAS1R3TAS1R1MCHR1HTR4SMN1; SMN2
SCHEMBL4240643 0.89 PDE4D (0.42) TAS1R3TAS1R1MCHR1PKMHTR4
SCHEMBL4238014 0.88 PKM (0.40) TAS1R3TAS1R1MCHR1PKMHTR4
SCHEMBL4233744 0.87 MAPT (0.39) TAS1R3TAS1R1MCHR1HTR4SMN1; SMN2
SCHEMBL4745919 0.87 KDR (0.38) MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US claimed
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
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
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 TAS1R3 1436/4885TAS1R1 1073/4885MCHR1 47/4885

“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.