SCHEMBL7952610

SCHEMBL7952610

Cc1cc(C(=N)N)c(C)cc1Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.51
TEAD1 P28347 3/20 0.44
MAPT P10636 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ICAM1 P05362 1/20 0.42
SELE P16581 1/20 0.42
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
RECQL P46063 1/20 0.39
PRSS1 P07477 1/20 0.39
ACR P10323 1/20 0.39
F2 P00734 1/20 0.39
FURIN P09958 1/20 0.39
RAB9A P51151 1/20 0.38
USP2 O75604 1/20 0.38

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
SCHEMBL4608873 0.80 MAPT (0.55) F10TEAD1MAPTL3MBTL1NPSR1
SCHEMBL7951506 0.78 F10 (0.50) F10TEAD1MAPTL3MBTL1NPSR1
SCHEMBL7649656 0.78 TEAD1 (0.40) F10TEAD1MAPTL3MBTL1NPSR1
SCHEMBL6030331 0.76 CHEK2 (0.39) F10F2
SCHEMBL6141347 0.76 TEAD1 (0.41) F10TEAD1MAPTL3MBTL1NPSR1
SCHEMBL6029770 0.75 MRGPRX4 (0.37) F10
SCHEMBL24497305 0.74 TEAD1 (0.53) F10TEAD1MAPTL3MBTL1NPSR1
SCHEMBL2748096 0.74 L3MBTL1 (0.55) F10TEAD1MAPTL3MBTL1NPSR1
SCHEMBL25472566 0.74 TEAD1 (0.55) F10TEAD1MAPTL3MBTL1NPSR1
SCHEMBL14586640 0.74 NPSR1 (0.50) TEAD1MAPTL3MBTL1NPSR1KDM4E

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-1150944-A1 N2-PHENYLAMIDINE DERIVATIVES Aventis CropScience GmbH (DE) 2001-11-07 EP disclosed
WO-2000046184-A1 N2-PHENYLAMIDINE DERIVATIVES AVENTIS CROPSCIENCE GMBH (FR) 2000-08-10 WO disclosed