SCHEMBL27447108

SCHEMBL27447108

BNCc1cc2ccc(O)cc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 1/20 0.46
▸ CA2 P00918 1/20 0.42
▸ TYR P14679 1/20 0.39
▸ CDK5 Q00535 5/20 0.38
▸ CDK5R1 Q15078 5/20 0.38
▸ NLRP3 Q96P20 1/20 0.37
▸ HRH4 Q9H3N8 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ RAD51 Q06609 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ PLAU P00749 1/20 0.35
▸ MIF P14174 1/20 0.34

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
SCHEMBL27247736 0.79 CA2 (0.43) OPRK1CA2NLRP3HRH4MIF
SCHEMBL27247096 0.77 LOXL2 (0.58) OPRK1CA2TYRCDK5CDK5R1
SCHEMBL12979838 0.77 CA2 (0.46) OPRK1CA2TYRCDK5CDK5R1
SCHEMBL27785505 0.77 CA2 (0.46) OPRK1CA2TYRCDK5CDK5R1
SCHEMBL27247248 0.75 MTNR1A (0.51) OPRK1CA2NLRP3HRH4ALOX15
SCHEMBL15598348 0.73 MTNR1A (0.47) OPRK1CA2TYRCDK5CDK5R1
SCHEMBL16884321 0.73 METTL3 (0.48) OPRK1
SCHEMBL30920730 0.71 NQO2 (0.48) OPRK1CA2HRH4MIF
SCHEMBL27247390 0.71 METTL3 (0.39) OPRK1CA2HRH4MIF
SCHEMBL7622759 0.70 TAAR1 (0.49) CA2TYRCDK5CDK5R1HRH4

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
WO-2024112830-A1 INHIBITORS OF SOLUTE CARRIER FAMILY 6A MEMBER 19 (SLC6A19) AND METHODS OF USE THEREOF MAZE THERAPEUTICS, INC. (US) 2024-05-30 — — WO disclosed
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