SCHEMBL22154192

SCHEMBL22154192

COCCn1nncc1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.37
HCAR3 P49019 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 6/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
USP2 O75604 2/20 0.32
HSD17B10 Q99714 2/20 0.32
MAPK1 P28482 2/20 0.32
MGMT P16455 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
PTGS2 P35354 1/20 0.31
ALOX15 P16050 1/20 0.31
LRRK2 Q5S007 1/20 0.31

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
SCHEMBL27394469 0.89 MGMT (0.40) MPOALDH1A1SMN1; SMN2MGMTRAB9A
SCHEMBL12126327 0.79
SCHEMBL28185306 0.76 MGMT (0.38) MPOHCAR3ALDH1A1SMN1; SMN2MGMT
SCHEMBL16815524 0.76 MGMT (0.38) MPOHCAR3ALDH1A1SMN1; SMN2USP2
SCHEMBL23989422 0.75
SCHEMBL22154187 0.74 MGMT (0.38) ALDH1A1MGMT
SCHEMBL25745115 0.73 HCAR3 (0.49) HCAR3MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL16815462 0.72 GAA (0.41) HCAR3ALDH1A1SMN1; SMN2CYP3A4HSD17B10
SCHEMBL23989432 0.72
SCHEMBL22154190 0.71 ALDH1A1 (0.44) MEN1KMT2AALDH1A1SMN1; SMN2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023129518-A1 TUBULYSINS AND PROTEIN-TUBULYSIN CONJUGATES REGENERON PHARMACEUTICALS, INC. (US) 2023-07-06 WO disclosed
WO-2021262910-A2 TUBULYSINS AND PROTEIN-TUBULYSIN CONJUGATES REGENERON PHARMACEUTICALS, INC. (US) 2021-12-30 WO disclosed
WO-2020132658-A2 TUBULYSINS AND PROTEIN-TUBULYSIN CONJUGATES REGENERON PHARMACEUTICALS, INC. (US) 2020-06-25 WO disclosed