SCHEMBL25298101

SCHEMBL25298101

COc1ccc2c(c1)c(CCNC(=O)O)nn2COCC[Si](C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MTNR1A P48039 16/20 0.41
▸ MTNR1B P49286 16/20 0.41
▸ NQO2 P16083 2/20 0.41
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38

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
SCHEMBL30565955 0.88 BRD4 (0.43) MTNR1AMTNR1BNQO2NPC1RAB9A
SCHEMBL25793072 0.88 BRD4 (0.43) MTNR1AMTNR1BNQO2NPC1RAB9A
SCHEMBL25254239 0.83 ADRB2 (0.43) NPC1
SCHEMBL30565933 0.80 HTR1A (0.40) NQO2
SCHEMBL25247836 0.80 HTR1A (0.40) NQO2
SCHEMBL25293730 0.79 HTR6 (0.35) —
SCHEMBL30565949 0.79 HTR2A (0.42) —
SCHEMBL25248599 0.79 HTR2A (0.42) —
SCHEMBL25248211 0.78 HTR6 (0.38) —
SCHEMBL25249736 0.77 ALDH1A1 (0.33) MTNR1AMTNR1BNPC1

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-2023115165-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-06-29 — — WO disclosed
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