SCHEMBL22815243

SCHEMBL22815243

CC(=O)CCCC(=O)NCC(O)CO

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.36
EPHX2 P34913 2/20 0.36
ASAH1 Q13510 1/20 0.36
LMNA P02545 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
TSHR P16473 1/20 0.35
FAAH O00519 2/20 0.35
HPGD P15428 2/20 0.35
MAPT P10636 1/20 0.34
ALDH1A1 P00352 1/20 0.33
RECQL P46063 1/20 0.33
ACHE P22303 1/20 0.32
PAOX Q6QHF9 1/20 0.32

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
SCHEMBL20149852 1.00 PTPN1 (0.36) PTPN1EPHX2ASAH1LMNACYP2C19
SCHEMBL14725897 0.89 ALDH1A1 (0.40) PTPN1EPHX2ASAH1LMNACYP2C19
SCHEMBL18608295 0.83 PTPN1 (0.37) PTPN1EPHX2ASAH1TSHRFAAH
SCHEMBL14700212 0.83 PTPN1 (0.37) PTPN1EPHX2ASAH1TSHRFAAH
SCHEMBL14700211 0.83 PTPN1 (0.44) PTPN1ASAH1LMNATSHRFAAH
SCHEMBL23799216 0.81 FAAH (0.55) ASAH1LMNAFAAH
SCHEMBL31549547 0.81 PTPN1 (0.42) PTPN1ASAH1LMNATSHRFAAH
SCHEMBL22821571 0.81 KDM4E (0.44) EPHX2ASAH1LMNATSHRHPGD
SCHEMBL29331428 0.81 KDM4E (0.44) EPHX2ASAH1LMNATSHRHPGD
SCHEMBL23869653 0.81 RECQL (0.34) PTPN1EPHX2ASAH1LMNACYP2C19

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3983020-B1 AGENTS FOR CLEAVING LABELS FROM BIOMOLECULES IN VIVO TAGWORKS PHARMACEUTICALS B V (NL) 2024-06-26 EP disclosed
WO-2024080872-A1 STRAINED BICYCLONONENES TAGWORKS PHARMACEUTICALS B.V. (NL) 2024-04-18 WO disclosed
WO-2023158305-A1 MASKED IL12 PROTEIN TAGWORKS PHARMACEUTICALS B.V. (NL) 2023-08-24 WO disclosed
WO-2020256545-A1 AGENTS FOR CLEAVING LABELS FROM BIOMOLECULES IN VIVO TAGWORKS PHARMACEUTICALS B.V. (NL) 2020-12-24 WO disclosed
WO-2020256546-A1 COMPOUNDS FOR FAST AND EFFICIENT CLICK RELEASE TAGWORKS PHARMACEUTICALS B.V. (NL) 2020-12-24 WO disclosed
WO-2020256544-A1 TETRAZINES FOR HIGH CLICK RELEASE SPEED AND YIELD TAGWORKS PHARMACEUTICALS B.V. (NL) 2020-12-24 WO disclosed