SCHEMBL26949032

SCHEMBL26949032

O=Cc1ccc(N2CCC(Oc3ccc(OCl)cc3)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TRIM24 O15164 1/20 0.49
▸ TRIM33 Q9UPN9 1/20 0.49
▸ ALDH1A1 P00352 4/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ FFAR4 Q5NUL3 1/20 0.42
▸ ACACB O00763 6/20 0.41
▸ NAMPT P43490 1/20 0.40
▸ FFAR1 O14842 2/20 0.39
▸ HRH1 P35367 2/20 0.39
▸ CCR3 P51677 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ HRH3 Q9Y5N1 2/20 0.39

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
SCHEMBL2097441 0.83 EPHX2 (0.55) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2
SCHEMBL833489 0.77 ALDH1A1 (0.58) ALDH1A1KDM4ESMN1; SMN2HRH1
SCHEMBL223917 0.76 HRH3 (0.58) ALDH1A1KDM4ESMN1; SMN2HRH1HRH3
SCHEMBL11912880 0.76 ALDH1A1 (0.47) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2
SCHEMBL23636689 0.76 LIPG (0.52) ACACB
SCHEMBL3636729 0.75 ALDH1A1 (0.56) ALDH1A1KDM4ESMN1; SMN2
SCHEMBL2000967 0.75 HRH3 (0.52) ALDH1A1KDM4EKCNH2HRH3
SCHEMBL20694203 0.75 TRIM24 (0.42) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2
SCHEMBL2005027 0.74 HRH3 (0.58) KCNH2HRH3
SCHEMBL510213 0.73 ALDH1A1 (0.55) ALDH1A1KDM4E

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-2023237580-A1 TRICYCLIC SPIROLACTAM COMPOUNDS WITH ANTIMYCOBACTERIAL ACTIVITY INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 2023-12-14 — — WO disclosed
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