SCHEMBL24259802

SCHEMBL24259802

BNC(=O)CCN1C(=O)CCC1=O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
HPGD P15428 3/20 0.42
HTT P42858 2/20 0.42
ALDH1A1 P00352 5/20 0.41
MAPT P10636 2/20 0.41
ALPL P05186 1/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
HSD17B10 Q99714 2/20 0.38
ALOX12 P18054 1/20 0.37
TSHR P16473 2/20 0.36

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
SCHEMBL4414715 0.80 MAPT (0.48) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL14227570 0.80 SMN1; SMN2 (0.45) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL21119414 0.77 SMN1; SMN2 (0.50) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL18943850 0.77 SMN1; SMN2 (0.38) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL14934677 0.76 HTT (0.52) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL29229819 0.74 SMN1; SMN2 (0.51) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL14930710 0.74 SMN1; SMN2 (0.51) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL18471568 0.74 SMN1; SMN2 (0.51) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL13268072 0.74 SMN1; SMN2 (0.55) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL57076 0.74 ALDH1A1 (0.54) SMN1; SMN2HPGDHTTALDH1A1POLB

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