SCHEMBL14044201

SCHEMBL14044201

Cc1c(Cl)c(S(C)(=O)=O)nn1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.38
NMT1 P30419 3/20 0.35
HPGD P15428 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 4/20 0.33
LMNA P02545 1/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
CCR1 P32246 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
ALPL P05186 3/20 0.32
MITF O75030 1/20 0.32
MAPT P10636 1/20 0.32
APEX1 P27695 1/20 0.32
APOBEC3A P31941 1/20 0.32
HTT P42858 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
GAA P10253 3/20 0.31
GLP1R P43220 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
SCHEMBL16200296 0.75 NMT1 (0.33) POLBNMT1ALDH1A1LMNACA12
SCHEMBL13184172 0.75 CCR1 (0.40) ALDH1A1LMNACCR1SMN1; SMN2HTT
SCHEMBL14463701 0.71 NMT1 (0.38) POLBNMT1L3MBTL1ALDH1A1CA12
SCHEMBL1196790 0.69
SCHEMBL13784458 0.67
SCHEMBL1196791 0.67
SCHEMBL13683113 0.67 KDM4E (0.41) NMT1L3MBTL1ALDH1A1LMNACA12
SCHEMBL8232738 0.65 TSHR (0.45) NMT1ALDH1A1CA12CA2CA9
SCHEMBL20843888 0.64
SCHEMBL14039593 0.64

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
EP-1720545-B1 BICYCLIC AND BRIDGED NITROGEN HETEROCYCLES CHEMOCENTRYX INC (US) 2014-10-29 EP disclosed
US-7435831-B2 Bicyclic and bridged nitrogen heterocycles CHEMOCENTRYX, INC. (US) 2008-10-14 US disclosed