SCHEMBL22814737

SCHEMBL22814737

CC(=O)CCC(=O)NCC(O)CN

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
GABRR1 P24046 3/20 0.34
LMNA P02545 2/20 0.34
PAOX Q6QHF9 2/20 0.33
SLC15A2 Q16348 1/20 0.33
MMP2 P08253 1/20 0.33
TPSAB1 Q15661 1/20 0.32
GABBR2 O75899 1/20 0.31
GABBR1 Q9UBS5 1/20 0.31
TLR2 O60603 2/20 0.31
ASAH1 Q13510 1/20 0.30
EPHX2 P34913 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
SCHEMBL24462473 0.82 CTSD (0.45) ALDH1A1GABRR1LMNATLR2ASAH1
SCHEMBL14725897 0.82 ALDH1A1 (0.40) ALDH1A1LMNASLC15A2ASAH1EPHX2
SCHEMBL22123634 0.82 MMP2 (0.46) ALDH1A1GABRR1LMNAMMP2TLR2
SCHEMBL29313282 0.81 TLR2 (0.33) ALDH1A1GABRR1LMNAMMP2TPSAB1
SCHEMBL22821244 0.80 ALDH1A1 (0.32) ALDH1A1GABRR1LMNAMMP2
SCHEMBL27108993 0.78 ALDH1A1 (0.47) ALDH1A1LMNASLC15A2ASAH1EPHX2
SCHEMBL22123760 0.77 MMP2 (0.42) GABRR1LMNAMMP2GABBR2GABBR1
SCHEMBL16985031 0.77 GABRR1 (0.34) ALDH1A1GABRR1LMNAMMP2
SCHEMBL13351409 0.77 FAAH (0.56) TLR2ASAH1
SCHEMBL16985022 0.76 GABRR1 (0.33) GABRR1LMNAMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024146902-A1 METHODS OF PRODUCING HYDROGEL MICROSPHERES ASCENDIS PHARMA A/S (DK) 2024-07-11 WO disclosed
WO-2024146920-A1 DRUG CONJUGATES FOR THE TREATMENT OF OCULAR DISORDERS ASCENDIS PHARMA OPHTHALMOLOGY DIVISION A/S (DK) 2024-07-11 WO disclosed
WO-2021136808-A1 CONJUGATES UNDERGOING INTRAMOLECULAR REARRANGEMENTS ASCENDIS PHARMA A/S (DK) 2021-07-08 WO disclosed
WO-2020254617-A1 ANTI-CTLA4 COMPOUNDS WITH LOCALIZED PK PROPERTIES Ascendis Pharma Oncology Division A/S (DK) 2020-12-24 WO disclosed
WO-2020254607-A1 ANTI-CTLA4 COMPOUNDS WITH LOCALIZED PD PROPERTIES Ascendis Pharma Oncology Division A/S (DK) 2020-12-24 WO disclosed