SCHEMBL30487147

SCHEMBL30487147

CN[C@@H]1c2ccccc2OC[C@H]1NC(=O)[C@@H](C)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 9/20 0.61
P2RX7 Q99572 2/20 0.40
TRPM8 Q7Z2W7 1/20 0.38
POLB P06746 1/20 0.35
LTB4R Q15722 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.35

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
SCHEMBL21542241 1.00 GRM7 (0.61) GRM7P2RX7TRPM8POLBLTB4R
SCHEMBL21542240 1.00 GRM7 (0.61) GRM7P2RX7TRPM8POLBLTB4R
SCHEMBL20166003 1.00 GRM7 (0.61) GRM7P2RX7TRPM8POLBLTB4R
SCHEMBL20166004 1.00 GRM7 (0.61) GRM7P2RX7TRPM8POLBLTB4R
SCHEMBL20166001 1.00 GRM7 (0.61) GRM7P2RX7TRPM8POLBLTB4R
SCHEMBL21542298 0.91 GRM7 (0.71) GRM7P2RX7POLB
SCHEMBL21542296 0.91 GRM7 (0.71) GRM7P2RX7POLB
SCHEMBL20182784 0.91 GRM7 (0.71) GRM7P2RX7POLB
SCHEMBL20165981 0.86 GRM7 (0.75) GRM7P2RX7TRPM8LTB4RLTB4R2
SCHEMBL20165979 0.86 GRM7 (0.75) GRM7P2RX7TRPM8LTB4RLTB4R2

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
EP-3541812-B1 MGLUR7 AGONIST COMPOUNDS FOR TREATING MGLUR7- REGULATED DISEASES, DISORDERS, OR CONDITIONS TAKEDA PHARMACEUTICALS CO (JP) 2023-06-14 EP disclosed