SCHEMBL29107254

SCHEMBL29107254

CC1Sc2ccccc2N1Cc1ccc(C(C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.41
▸ DRD4 P21917 1/20 0.41
▸ PPARG P37231 1/20 0.39
▸ HTT P42858 3/20 0.38
▸ TP53 P04637 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ METAP2 P50579 1/20 0.37
▸ POLB P06746 3/20 0.37
▸ KMT2A Q03164 3/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ GPR55 Q9Y2T6 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ HPGD P15428 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
SCHEMBL29107247 0.87 CHRM5 (0.43) DRD2DRD4PPARGHTTTP53
SCHEMBL21803243 0.85 GSK3B (0.44) PPARGTP53LMNASMN1; SMN2GSK3B
SCHEMBL29107250 0.84 PPARG (0.41) DRD2DRD4PPARGTP53
Iodide SCHEMBL28993212 0.83 GSK3B (0.43) PPARGTP53LMNASMN1; SMN2GSK3B
SCHEMBL29107251 0.82 PPARG (0.40) PPARGTP53LMNAPOLBKMT2A
SCHEMBL29107246 0.82 SMN1; SMN2 (0.48) DRD2DRD4PPARGTP53KMT2A
SCHEMBL29107248 0.78 SIRT2 (0.40) HTTTP53LMNAPOLBKMT2A
SCHEMBL29107245 0.75 MEN1 (0.51) PPARGTP53KMT2AGAAMEN1
SCHEMBL16709169 0.74 MAOA (0.38) PPARGPOLBKMT2AMEN1SMN1; SMN2
SCHEMBL16709179 0.74 MAOA (0.42) DRD2DRD4TP53LMNAPOLB

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
CN-117069742-A Spiro [ pyridine-thiazolidine ] compound and preparation method and application thereof 五邑大学 2023-11-17 — — CN disclosed
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