SCHEMBL25808563

SCHEMBL25808563

Cc1nnc(SCC(=O)N2CCCC2)s1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.70
▸ ATM Q13315 2/20 0.68
▸ ALDH1A1 P00352 8/20 0.61
▸ L3MBTL1 Q9Y468 3/20 0.61
▸ GAA P10253 3/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.57
▸ KDM4E B2RXH2 2/20 0.57
▸ HPGD P15428 3/20 0.56
▸ HSD17B10 Q99714 2/20 0.56
▸ MAPT P10636 3/20 0.56
▸ TP53 P04637 2/20 0.56
▸ ALOX15 P16050 1/20 0.53
▸ LMNA P02545 1/20 0.52
▸ HSD11B1 P28845 1/20 0.51
▸ TSHR P16473 1/20 0.50

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
SCHEMBL25335374 0.89 ATM (0.77) PKMATMALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL18719836 0.82 ATM (0.97) PKMATMALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL29987226 0.79 ALDH1A1 (0.65) PKMALDH1A1L3MBTL1GAASMN1; SMN2
SCHEMBL24814437 0.79 ALDH1A1 (0.65) PKMALDH1A1L3MBTL1GAASMN1; SMN2
SCHEMBL15337908 0.75 PKM (0.60) PKMATMALDH1A1L3MBTL1GAA
SCHEMBL10402042 0.75 GAA (0.73) ALDH1A1L3MBTL1GAAHPGDMAPT
SCHEMBL1686848 0.75 GAA (1.00) ALDH1A1L3MBTL1GAAHPGDMAPT
SCHEMBL11927276 0.75 GAA (0.73) ALDH1A1L3MBTL1GAASMN1; SMN2HPGD
SCHEMBL11522387 0.74 GAA (0.71) PKMALDH1A1L3MBTL1GAAHPGD
SCHEMBL11802526 0.74 GAA (0.71) ALDH1A1L3MBTL1GAAHPGDMAPT

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-2023133240-A1 COMPOSITIONS, FORMULATIONS, AND METHODS FOR SKIN TREATMENT REVELA, INC. (US) 2023-07-13 — — WO disclosed
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