SCHEMBL26831785

SCHEMBL26831785

Cc1cc(C(=O)N2CCOCC2)n(C)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 1/20 0.51
▸ AR P10275 6/20 0.49
▸ HTT P42858 2/20 0.49
▸ HPGD P15428 4/20 0.47
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ LMNA P02545 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ MAPT P10636 1/20 0.43

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
SCHEMBL1663195 0.83 HRH3 (0.50) HRH3ARHTTHPGDSMN1; SMN2
SCHEMBL27316791 0.77 L3MBTL1 (0.45) HRH3ARHPGDNPC1RAB9A
SCHEMBL20581159 0.77 TP53 (0.50) HRH3ARRAB9ALMNA
SCHEMBL20158924 0.75 AR (0.44) HRH3ARLMNA
SCHEMBL26831781 0.74 AR (0.43) ARRAB9ALMNAALDH1A1
SCHEMBL14930399 0.73 SMN1; SMN2 (0.51) HTTHPGDNPC1RAB9ALMNA
SCHEMBL6465429 0.73 HPGD (0.68) HTTHPGDLMNASMN1; SMN2KDM4E
SCHEMBL5655224 0.72 ALDH1A1 (0.69) HPGDSMN1; SMN2ALDH1A1MAPT
SCHEMBL27249721 0.70 NPC1 (0.47) HRH3HTTHPGDNPC1RAB9A
SCHEMBL17473523 0.70 SMN1; SMN2 (0.48) HTTHPGDNPC1RAB9ASMN1; SMN2

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
WO-2024057020-A1 ANTI-VIRAL COMPOUNDS Infex Therapeutics Limited (GB) 2024-03-21 — — WO disclosed
WO-2023223055-A1 ANTI-VIRAL COMPOUNDS Infex Therapeutics Limited (GB) 2023-11-23 — — WO disclosed
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