SCHEMBL14404174

SCHEMBL14404174

C/C(=N\NC(=O)c1ccc(Cl)cc1)c1cc(C)ccc1N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
LMNA P02545 2/20 0.54
GAA P10253 2/20 0.54
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA4 P22748 1/20 0.53
CA9 Q16790 1/20 0.53
KDM1A O60341 2/20 0.52
NPC1 O15118 7/20 0.50
RAB9A P51151 5/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CYP1A2 P05177 3/20 0.49
CYP2C19 P33261 3/20 0.49
CYP3A4 P08684 3/20 0.49
AGTR1 P30556 1/20 0.49
OPRK1 P41145 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL14399944 0.91 KDM1A (0.62) MAPTLMNAGAACA1CA2
SCHEMBL14404141 0.87 RAB9A (0.57) MAPTLMNAGAACA1CA2
SCHEMBL683934 0.86 KDM1A (0.70) MAPTLMNAGAACA1CA2
SCHEMBL14404178 0.85 MAPT (0.53) MAPTLMNAGAAKDM1ANPC1
SCHEMBL14404177 0.84 MAPT (0.46) MAPTLMNACA1CA2CA4
SCHEMBL14399689 0.83 KDM1A (0.74) MAPTCA1CA2CA4CA9
SCHEMBL6571403 0.83 NPC1 (0.59) MAPTLMNAGAACA1CA2
SCHEMBL6571399 0.83 NPC1 (0.59) MAPTLMNAGAACA1CA2
SCHEMBL14404175 0.81 ALDH1A1 (0.56) MAPTLMNAGAANPC1RAB9A
SCHEMBL14404040 0.81 MAPT (0.45) MAPTLMNAGAANPC1RAB9A

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
WO-2007116314-A1 N-PHENYL-1,1,1-TRIFLUOROMETHANESULFONAMIDE HYDRAZONE DERIVATIVE COMPOUNDS AND THEIR USAGE IN CONTROLLING PARASITES SCHERING-PLOUGH LTD. (US) 2007-10-18 WO disclosed