SCHEMBL24259832

SCHEMBL24259832

O=C(S)NCCN1C(=O)CCC1=O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
HTT P42858 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.42
HPGD P15428 1/20 0.42
ALDH1A1 P00352 6/20 0.38
GAA P10253 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
ALOX12 P18054 1/20 0.33
POLB P06746 2/20 0.33
ALPL P05186 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.32
FGF2 P09038 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
SCHEMBL24777174 0.77 MTNR1A (0.56) KMT2AMEN1HTTSMN1; SMN2HPGD
SCHEMBL20087406 0.77 KMT2A (0.47) KMT2AMEN1HTTSMN1; SMN2HPGD
SCHEMBL20246935 0.76 MGLL (0.46) HTTSMN1; SMN2HPGDALDH1A1LMNA
SCHEMBL6897850 0.76 KMT2A (0.49) KMT2AMEN1HTTSMN1; SMN2HPGD
SCHEMBL24777177 0.76 KMT2A (0.49) KMT2AMEN1HTTSMN1; SMN2HPGD
SCHEMBL10278649 0.74 KMT2A (0.48) KMT2AMEN1HTTSMN1; SMN2HPGD
SCHEMBL15934070 0.74 KMT2A (0.35) KMT2AMEN1HTTSMN1; SMN2ALDH1A1
SCHEMBL1108308 0.73 MEN1 (0.44) KMT2AMEN1HTTSMN1; SMN2HPGD
SCHEMBL21389198 0.72 TDP1 (0.46) KMT2AMEN1HTTSMN1; SMN2HPGD
SCHEMBL31576104 0.72 MEN1 (0.43) KMT2AMEN1HTTSMN1; SMN2HPGD

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
EP-3432934-B1 PRODRUGS OF CYTOTOXIC AGENTS WITH ENZYMATICALLY CLEAVABLE GROUPS Bayer Pharma AG (DE) 2022-02-23 EP disclosed