SCHEMBL27749583

SCHEMBL27749583

Clc1ccccc1Oc1ccccc1.O=S(=O)(Cl)Cl

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.53
POLB P06746 1/20 0.53
MAPT P10636 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.48
PGR P06401 1/20 0.46
NR1H2 P55055 1/20 0.46
CXCL8 P10145 1/20 0.46
LMNA P02545 2/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
HPGD P15428 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPK8 P45983 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL3790160 0.89 DPP4 (0.62) DPP4POLBMAPTL3MBTL1NR1H2
Ammonia Solution, Strong SCHEMBL4267774 0.87 DPP4 (0.60) DPP4POLBMAPTL3MBTL1NR1H2
Ethane SCHEMBL27569819 0.85 DPP4 (0.58) DPP4POLBMAPTL3MBTL1CXCL8
SCHEMBL732827 0.83 KMT2A (0.48) KMT2AALDH1A1TDP1
SCHEMBL7176453 0.83 DPP4 (0.53) DPP4MAPTL3MBTL1CXCL8LMNA
SCHEMBL10709985 0.81 HTT (0.51) KMT2A
Diphenylether SCHEMBL130202 0.80 LTA4H (0.67) PGRNR1H2LMNAHPGDALDH1A1
SCHEMBL27474613 0.80 FAAH (0.60) MAPTLMNAGAAKMT2AHPGD
SCHEMBL6299006 0.79 POLB (0.49) DPP4POLBMAPTL3MBTL1ALDH1A1
SCHEMBL27749722 0.78 PTGS2 (0.46) POLBMAPTL3MBTL1NR1H2LMNA

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
CN-101378757-A Thiadiazole derivatives for the treatment of neuro degenerative diseases REMYND NV (BE) 2009-03-04 CN disclosed