SCHEMBL30714583

SCHEMBL30714583

CN(C)C(=O)C(C)(CO)NC(=O)c1c2cc(OCc3cccnc3C(F)(F)F)ccc2nn1C

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.33
MCHR1 Q99705 5/20 0.31
CD38 P28907 1/20 0.31
KLKB1 P03952 1/20 0.31
GRM2 Q14416 1/20 0.31
SSTR4 P31391 1/20 0.31
KDM4C Q9H3R0 1/20 0.30
RECQL P46063 1/20 0.30
GCK P35557 2/20 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
SCHEMBL26696066 1.00 OPRL1 (0.33) OPRL1MCHR1CD38KLKB1GRM2
SCHEMBL30714598 0.90 OPRL1 (0.35) OPRL1MCHR1CD38KLKB1GRM2
SCHEMBL30714582 0.88 CNR2 (0.37) OPRL1MCHR1CD38KLKB1SSTR4
SCHEMBL30714749 0.88 OPRL1 (0.35) OPRL1MCHR1CD38KLKB1GRM2
SCHEMBL30714600 0.85 TYK2 (0.38) OPRL1MCHR1CD38KLKB1GRM2
SCHEMBL26868368 0.84 OPRL1 (0.34) OPRL1MCHR1CD38KLKB1GRM2
SCHEMBL31539903 0.82 OPRL1 (0.34) OPRL1MCHR1CD38KLKB1GRM2
SCHEMBL26696085 0.82 NPC1 (0.37) OPRL1MCHR1CD38KLKB1GRM2
SCHEMBL30714557 0.82 NPC1 (0.37) OPRL1MCHR1CD38KLKB1GRM2
SCHEMBL30714722 0.82 KDM4C (0.39) OPRL1GRM2KDM4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4499624-A2 INDAZOLE DERIVATIVES FOR TREATING TRPM3-MEDIATED DISORDERS Katholieke Universiteit Leuven KU Leuven Research & Development (BE) 2025-02-05 EP disclosed
WO-2023230540-A2 INDAZOLE DERIVATIVES FOR TREATING TRPM3-MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed