SCHEMBL26242551

SCHEMBL26242551

CC1CCN([S+]([O-])c2ccccc2)C1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.39
SIGMAR1 Q99720 3/20 0.36
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
PKM P14618 1/20 0.35
TSHR P16473 1/20 0.35
GAA P10253 2/20 0.34
USP2 O75604 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
TLR7 Q9NYK1 1/20 0.32
MAPK1 P28482 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
SCHEMBL20846484 0.90 HPGD (0.43) HPGDSMN1; SMN2MEN1KMT2AGAA
SCHEMBL26003807 0.81 KDM4E (0.46) ACHEMEN1KMT2ACYP2C19
SCHEMBL1847673 0.81 DPP4 (0.32)
SCHEMBL3780842 0.81 DPP4 (0.32)
SCHEMBL3779703 0.77 RECQL (0.31)
SCHEMBL13840397 0.76 HPGD (0.41) ACHEHPGDSMN1; SMN2MEN1KMT2A
SCHEMBL8698034 0.75 SIGMAR1 (0.31) SIGMAR1MEN1KMT2A
SCHEMBL3771733 0.73 HPGD (0.31) HPGDSMN1; SMN2CYP3A4CYP2C19
SCHEMBL23373370 0.72 KMT2A (0.41) HPGDSMN1; SMN2KMT2ATSHRGAA
SCHEMBL20195364 0.71 KCNH2 (0.35) SIGMAR1HPGDTSHRGAACYP3A4

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-3262036-B1 THERAPEUTIC PYRIDAZINE COMPOUNDS AND USES THEREOF GENENTECH INC (US) 2023-09-13 EP disclosed