SCHEMBL31421853

SCHEMBL31421853

CCCCC(=O)N[C@@H](C)C(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.47
MEN1 O00255 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.42
SLC6A5 Q9Y345 1/20 0.42
CTSK P43235 3/20 0.41
HRH3 Q9Y5N1 1/20 0.41
BIRC2 Q13490 1/20 0.40
PRSS1 P07477 1/20 0.40
CTSG P08311 1/20 0.40
CTRB1 P17538 1/20 0.40
CMA1 P23946 1/20 0.40
CAPN1 P07384 1/20 0.39
ASAH2 Q9NR71 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
DNM1 Q05193 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
SCHEMBL7151886 0.94 FAAH (0.57) FAAHMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL7098518 0.94 FAAH (0.57) FAAHMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL31529071 0.94 FAAH (0.57) FAAHMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL31529223 0.94 FAAH (0.57) FAAHMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL7151887 0.94 FAAH (0.57) FAAHMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL25052856 0.90 FAAH (0.49) FAAHMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL28303046 0.86 FAAH (0.60) FAAHMEN1KMT2ASMN1; SMN2SLC6A5
SCHEMBL28303045 0.86 FAAH (0.60) FAAHMEN1KMT2ASMN1; SMN2SLC6A5
SCHEMBL25516747 0.85 HRH3 (0.40) FAAHMEN1MAPK1KMT2AHRH3
SCHEMBL21418111 0.85 PSMB5 (0.51) FAAHMEN1MAPK1KMT2ASMN1; SMN2

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
CN-119630672-A Camptothecin derivative and conjugate thereof, and preparation method and medical application thereof 一线医药(杭州)有限公司 2025-03-14 CN disclosed