SCHEMBL31207269

SCHEMBL31207269

CN1CCN(C(=O)C2CC=CCC2C(=O)O)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ GAA P10253 1/20 0.48
▸ POLB P06746 4/20 0.47
▸ TDP1 Q9NUW8 3/20 0.47
▸ HTT P42858 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ NPY1R P25929 1/20 0.45
▸ HIF1A Q16665 1/20 0.45
▸ PPP5C P53041 2/20 0.45
▸ PPP2CA P67775 1/20 0.45
▸ TFPI2 P48307 1/20 0.45
▸ NPY4R P50391 1/20 0.45
▸ LMNA P02545 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CTSB P07858 1/20 0.39
▸ CTSS P25774 1/20 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
SCHEMBL5605774 0.79 PPP5C (0.53) ALDH1A1TDP1HTTKDM4EPPP5C
SCHEMBL7457305 0.78 CTSB (0.40) ALDH1A1KMT2ATDP1HTTPPP5C
SCHEMBL5605778 0.76 CTSB (0.57) ALDH1A1TDP1HTTKDM4EPPP5C
SCHEMBL31207070 0.76 CTSB (0.57) ALDH1A1TDP1HTTKDM4EPPP5C
SCHEMBL10739512 0.73 POLB (0.54) ALDH1A1KMT2AGAAPOLBTDP1
SCHEMBL31737192 0.73 POLB (0.54) ALDH1A1KMT2AGAAPOLBTDP1
SCHEMBL14433706 0.73 POLB (0.54) ALDH1A1KMT2AGAAPOLBTDP1
SCHEMBL10739509 0.73 POLB (0.54) ALDH1A1KMT2AGAAPOLBTDP1
SCHEMBL60588 0.73 POLB (0.54) ALDH1A1KMT2AGAAPOLBTDP1
SCHEMBL174303 0.73 POLB (0.54) ALDH1A1KMT2AGAAPOLBTDP1

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
CN-118957804-A Novel composite antibacterial polyester fiber and preparation method thereof 江苏恒科新材料有限公司 2024-11-15 — — CN claimed
CN-118957804-A Novel composite antibacterial polyester fiber and preparation method thereof 江苏恒科新材料有限公司 2024-11-15 — — CN disclosed
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