SCHEMBL4232271

SCHEMBL4232271

COc1cc(N)ccc1Oc1ccc(N(C)C(=O)c2ccc(OC34CCCC(CC3)N4C)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.38
LPAR1 Q92633 4/20 0.36
LPAR5 Q9H1C0 4/20 0.36
TP53 P04637 1/20 0.35
HSD17B1 P14061 2/20 0.35
HSD17B2 P37059 2/20 0.35
MLNR O43193 1/20 0.33
MET P08581 1/20 0.32
TTR P02766 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.31

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
SCHEMBL4228368 0.88 LPAR1 (0.39) MCHR1LPAR1LPAR5
SCHEMBL4240821 0.88 TP53 (0.38) MCHR1LPAR1LPAR5TP53POLB
SCHEMBL4231972 0.87 ALDH1A1 (0.40) MCHR1LPAR1LPAR5TP53MET
SCHEMBL4242456 0.83 PKM (0.37) MCHR1LPAR1LPAR5KMT2A
SCHEMBL4229369 0.79 CYP1A2 (0.40) TP53METKMT2A
SCHEMBL13699126 0.78 CYP2D6 (0.48) MCHR1LPAR1LPAR5HSD17B1HSD17B2
SCHEMBL4235504 0.77 ALDH1A1 (0.41) LPAR1LPAR5TTRPOLBKMT2A
SCHEMBL4226767 0.76 ALDH1A1 (0.36) MCHR1LPAR1LPAR5METTTR
SCHEMBL4241978 0.76 PKM (0.36) MCHR1LPAR1LPAR5KMT2A
SCHEMBL4233732 0.75 MCHR1 (0.35) MCHR1LPAR1LPAR5KMT2A

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 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 (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 47/4885LPAR1 277/4885LPAR5 203/4885

“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.