SCHEMBL8419964

SCHEMBL8419964

CNc1cccc(-c2cc(-c3ccc(Cl)cc3)n(NS(=O)(=O)c3ccccc3)n2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
ALDH1A1 P00352 4/20 0.42
HPGD P15428 4/20 0.42
HTT P42858 2/20 0.42
KAT6A Q92794 1/20 0.40
LMNA P02545 3/20 0.39
GAA P10253 2/20 0.39
KDM4E B2RXH2 1/20 0.39
PAX8 Q06710 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
KDM1A O60341 2/20 0.38
PGR P06401 1/20 0.38
MAOA P21397 1/20 0.38
AURKA O14965 1/20 0.38
MALT1 Q9UDY8 1/20 0.38
CYP19A1 P11511 1/20 0.37
CNR1 P21554 1/20 0.37
PTGS2 P35354 1/20 0.37

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
SCHEMBL8423779 0.96 MAPT (0.40) MAPTALDH1A1HPGDHTTKAT6A
SCHEMBL8421856 0.90 KDM1A (0.41) MAPTALDH1A1LMNAGAASMN1; SMN2
SCHEMBL8420103 0.88 PTGS2 (0.45) MAPTKAT6ALMNAKDM1APGR
SCHEMBL8641119 0.88 AURKA (0.46) MAPTHTTKAT6AGAAKDM4E
SCHEMBL8422282 0.87 KDM1A (0.43) MAPTALDH1A1HPGDHTTKAT6A
SCHEMBL8421776 0.87 KDM1A (0.47) MAPTHTTKAT6AGAAKDM4E
SCHEMBL8424142 0.85 KAT6A (0.47) ALDH1A1HPGDKAT6ALMNAGAA
SCHEMBL8423597 0.85 KAT6A (0.42) MAPTALDH1A1HPGDHTTKAT6A
SCHEMBL8421734 0.85 KDM1A (0.43) MAPTHTTKAT6ALMNAGAA
SCHEMBL8420734 0.85 MALT1 (0.43) MAPTKAT6AGAAKDM1APGR

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
US-5908852-A 1,3,5 trisubstituted pyrazole compounds for treatment of inflammation G. D. SEARLE & CO. (US) 1999-06-01 US disclosed