SCHEMBL697528

SCHEMBL697528

Cc1cccc(C(C)c2nccn2CC(CC2CCCC2)C(=O)O)c1C

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 2/20 0.34
OPRD1 P41143 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
USP19 O94966 1/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.31
CCKBR P32239 1/20 0.31
LDHA P00338 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP12 P39900 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GRIN2B Q13224 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
SCHEMBL1573270 0.84 KMT2A (0.38) SMN1; SMN2KMT2AMEN1LMNAGRIN2B
SCHEMBL1573396 0.83 ITGB3 (0.37) SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL1573428 0.81 APAF1 (0.42) SMN1; SMN2KMT2AMEN1LMNATSHR
SCHEMBL697530 0.80 PTGS2 (0.37) IDH1SMN1; SMN2
SCHEMBL1573149 0.80 PTGES (0.40) SMN1; SMN2KMT2AMEN1
SCHEMBL1574142 0.79 SMN1; SMN2 (0.37) SMN1; SMN2KMT2AMEN1TSHRGRIN2B
SCHEMBL697529 0.77 KLK7 (0.37) OPRD1SMN1; SMN2KMT2AMEN1NPC1
SCHEMBL696942 0.76 LDHA (0.38) KMT2AMEN1TSHRLDHAGRIN2B
SCHEMBL695810 0.74 GUCY1B2 (0.36) IDH1OPRD1KMT2AMEN1NPC1
SCHEMBL696567 0.74 IDH1 (0.42) IDH1KMT2AMEN1

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-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP claimed
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP disclosed