SCHEMBL27447992

SCHEMBL27447992

CCCNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC=O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 3/20 0.48
ADH1A P07327 3/20 0.48
ADH7 P40394 3/20 0.48
LMNA P02545 2/20 0.46
MCL1 Q07820 1/20 0.42
CNR1 P21554 2/20 0.41
ADH1C P00326 2/20 0.40
EPHX1 P07099 2/20 0.39
ADH4 P08319 1/20 0.39
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP9 P14780 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PAOX Q6QHF9 1/20 0.34
CASP2 P42575 1/20 0.34

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
SCHEMBL30520938 1.00 ADH1B (0.48) ADH1BADH1AADH7LMNAMCL1
SCHEMBL22455943 0.89 CNR1 (0.46) ADH1BADH1AADH7LMNAMCL1
SCHEMBL19114217 0.84 ADH1B (0.56) ADH1BADH1AADH7LMNACNR1
SCHEMBL25100357 0.83 LMNA (0.41) ADH1BADH1AADH7LMNAMCL1
SCHEMBL24287064 0.83 LMNA (0.41) ADH1BADH1AADH7LMNAMCL1
SCHEMBL25698991 0.81 LMNA (0.39) ADH1BADH1AADH7LMNACNR1
SCHEMBL14197494 0.80 MCL1 (0.42) ADH1BADH1AADH7LMNAMCL1
SCHEMBL24285705 0.79 LMNA (0.41) ADH1BADH1AADH7LMNAADH1C
SCHEMBL13922247 0.79
SCHEMBL14197498 0.79 MEN1 (0.58) LMNAMCL1CNR1EPHX1MMP1

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
WO-2024141575-A1 ANTIBODY-DRUG CONJUGATES TARGETING UPARAP COMPRISING EXATECAN DERIVATIVES ADCENDO APS (DK) 2024-07-04 WO disclosed