SCHEMBL24227326

SCHEMBL24227326

C=C/C=C\C(=C/C)Nc1cccc2cccc(S(=O)(=O)O)c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 1/20 0.48
▸ FABP4 P15090 1/20 0.48
▸ CCNA2 P20248 1/20 0.48
▸ CDK2 P24941 1/20 0.48
▸ MAPK14 Q16539 1/20 0.48
▸ NR4A1 P22736 1/20 0.47
▸ CD40 P25942 3/20 0.43
▸ CD40LG P29965 3/20 0.43
▸ CASP6 P55212 1/20 0.37
▸ SNCA P37840 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CHAT P28329 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CASP1 P29466 1/20 0.30

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
SCHEMBL27434635 0.80 GRIN2D (0.31) MAPTMEN1KMT2A
SCHEMBL27401064 0.74 KMT2A (0.47) KDM4EALDH1A1MAPTHPGDCYP1A2
SCHEMBL11759224 0.74 TTR (0.59) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL25957148 0.72 MMP1 (0.33) —
SCHEMBL23178061 0.72 TTR (0.64) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL26885009 0.72 TTR (0.56) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL18769044 0.69 TTR (0.60) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL22268029 0.69 GAA (0.42) TSHRKDM4EMAPTHPGDMEN1
SCHEMBL6242038 0.69 CD40 (0.61) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL6911279 0.69 TTR (0.64) TTRFABP4CCNA2CDK2MAPK14

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
EP-2247558-B2 NOVEL IMAGING AGENTS FOR DETECTING NEUROLOGICAL DYSFUNCTION LILLY CO ELI (US) 2024-07-03 — — EP disclosed
EP-2247558-B1 NOVEL IMAGING AGENTS FOR DETECTING NEUROLOGICAL DYSFUNCTION LILLY CO ELI (US) 2022-02-02 — — EP disclosed
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