SCHEMBL8670931

SCHEMBL8670931

CCCCS(=O)(=O)Nc1ccccc1C[S+]([O-])C1=NC(=S)C(C)(C)N1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 1/20 0.37
HPGD P15428 3/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
PGAM1 P18669 1/20 0.34
MRGPRX1 Q96LB2 1/20 0.34
BRD4 O60885 4/20 0.33
KCNK3 O14649 1/20 0.33
KCNK9 Q9NPC2 1/20 0.33
AR P10275 1/20 0.31
JAK1 P23458 1/20 0.31
LMNA P02545 1/20 0.31
KDR P35968 1/20 0.30

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
SCHEMBL8668357 0.94 PARP14 (0.35) PARP14ALDH1A1GAAMAPTBRD4
SCHEMBL8665811 0.91 PSIP1 (0.36) PARP14ALDH1A1MAPT
SCHEMBL8669025 0.86 PTGS1 (0.35) HPGDKDM4EALDH1A1JAK1
SCHEMBL8666442 0.83 NR3C1 (0.32)
SCHEMBL8669434 0.83 ALDH1A1 (0.40) KDM4EALDH1A1MAPTLMNA
SCHEMBL8670754 0.81 MAPT (0.44) KDM4EALDH1A1GAAMAPTLMNA
SCHEMBL8668472 0.80 AR (0.32) HPGDKDM4EALDH1A1MAPTAR
SCHEMBL8667079 0.79 POLB (0.53) HPGDKDM4EALDH1A1LMNA
SCHEMBL8668497 0.78
SCHEMBL8666674 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5750552-A ANTIULCER AGENTS ARAX CO., LTD. (JP) 1998-05-12 US disclosed
EP-0736527-A1 Imadazoline derivative, possible tautomer thereof, process of manufacturing therefor, and vulnerary including such derivative or tautomer ARAX CO., LTD. (JP) 1996-10-09 EP disclosed