SCHEMBL25748229

SCHEMBL25748229

CCCCc1ccc2[nH]cc(C(=O)C(=O)N(C)CC)c2c1OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ LTB4R Q15722 1/20 0.38
▸ LTB4R2 Q9NPC1 1/20 0.38
▸ PTGER4 P35408 2/20 0.37
▸ PTGER3 P43115 2/20 0.37
▸ PTGER2 P43116 2/20 0.37
▸ PTGER1 P34995 1/20 0.37
▸ HTR1D P28221 3/20 0.37
▸ GABRA1 P14867 3/20 0.37
▸ GABRB2 P47870 3/20 0.37
▸ TRPM8 Q7Z2W7 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MDH2 P40926 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ HSP90AA1 P07900 1/20 0.35
▸ HSP90AB1 P08238 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
SCHEMBL25748298 0.88 PTGER4 (0.37) SLC6A4HTR2ASMN1; SMN2NPC1LTB4R
SCHEMBL25426159 0.85 PTPN1 (0.38) HTR2ASMN1; SMN2LTB4RLTB4R2PTGER4
SCHEMBL25748242 0.80 HTR2A (0.39) SLC6A4HTR2ASMN1; SMN2LTB4RLTB4R2
SCHEMBL23805237 0.79 HTR2A (0.54) HTR2ASMN1; SMN2LTB4RLTB4R2PTGER1
SCHEMBL25748258 0.76 PTPN1 (0.39) HTR2ASMN1; SMN2LTB4RLTB4R2PTGER4
SCHEMBL1163488 0.76 HPGD (0.39) SLC6A4HTR2ASMN1; SMN2NPC1LTB4R
SCHEMBL25748279 0.75 HTR1D (0.39) HTR2ASMN1; SMN2HTR1DALDH1A1HPGD
SCHEMBL25748341 0.75 SMN1; SMN2 (0.39) HTR2ASMN1; SMN2ALDH1A1HPGDMDH2
SCHEMBL23805264 0.73 HTR2A (0.54) HTR2ALTB4RLTB4R2PTGER1GABRA1
SCHEMBL25748246 0.73 PTPN1 (0.38) HTR2ASMN1; SMN2PTGER4PTGER3PTGER2

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-2023115166-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-06-29 — — WO disclosed
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