SCHEMBL25328503

SCHEMBL25328503

C[C@@H]1CN[C@@H](c2ccccc2)CN1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 3/20 0.40
▸ OPRD1 P41143 3/20 0.40
▸ OPRK1 P41145 3/20 0.40
▸ POLB P06746 1/20 0.39
▸ ALOX5 P09917 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ RIPK1 Q13546 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.35
▸ HDAC2 Q92769 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
Bicarbonate SCHEMBL25326522 0.94 OPRM1 (0.38) OPRM1OPRD1OPRK1POLBALOX5
SCHEMBL14833616 0.89 POLB (0.49) OPRM1OPRD1OPRK1POLBALOX5
SCHEMBL25326429 0.87 SMN1; SMN2 (0.35) SMN1; SMN2KMT2ASIGMAR1
SCHEMBL25326553 0.85 RIPK1 (0.41) OPRM1OPRD1OPRK1POLBALOX5
SCHEMBL25326913 0.85 RIPK1 (0.50) OPRM1OPRD1OPRK1RIPK1
SCHEMBL25326466 0.83 OPRM1 (0.41) OPRM1OPRD1OPRK1POLBALOX5
SCHEMBL25326514 0.83 MEN1 (0.36) OPRM1OPRD1OPRK1POLBALOX5
SCHEMBL14813848 0.82 RORC (0.42) MEN1KMT2A
SCHEMBL14813850 0.82 RORC (0.42) MEN1KMT2A
SCHEMBL14813851 0.82 RORC (0.42) MEN1KMT2A

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-2023146991-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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