Anisole

Anisole

SCHEMBL19987888

COc1ccccc1.N=C=O.N=C=O.O=C=NCCCCN=C=O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.47
LTA4H P09960 2/20 0.41
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38
KIF11 P52732 1/20 0.36
KCNH2 Q12809 1/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SCN5A Q14524 1/20 0.35
SCN2A Q99250 1/20 0.35
G6PC1 P35575 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TRPA1 O75762 1/20 0.34
MIF P14174 2/20 0.34
HTT P42858 2/20 0.34
PKM P14618 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34

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
Anisole SCHEMBL15125 0.82 CA4 (0.70) CA4LTA4HDRD2DRD4DRD3
Anisole SCHEMBL4899174 0.82 CA4 (0.70) CA4LTA4HDRD2DRD4DRD3
Anisole SCHEMBL28841355 0.82 CA4 (0.70) CA4LTA4HDRD2DRD4DRD3
Anisole SCHEMBL10582653 0.80 CA4 (0.67) CA4LTA4HDRD2DRD4DRD3
Anisole SCHEMBL9825115 0.80 CA4 (0.67) CA4LTA4HDRD2DRD4DRD3
Toluene SCHEMBL1508677 0.79 LMNA (0.39) KIF11SCN5ASCN2AMIFNPC1
SCHEMBL8200727 0.77 CALM1 (0.50) L3MBTL1SCN5ASCN2ATDP1MIF
SCHEMBL3276462 0.76 KCNA3 (0.57) LTA4HDRD2DRD4DRD3RECQL
Anisole SCHEMBL28101084 0.76 CA4 (0.50) CA4LTA4HDRD2DRD4DRD3
Diphenylmethane SCHEMBL3882710 0.76 NAAA (0.46) TRPA1MIFMAOAMAOB

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3664984-B1 ISOCYANATE-FUNCTIONAL POLYMER COMPONENTS AND POLYURETHANE ARTICLES FORMED FROM RECYCLED POLYURETHANE ARTICLES AND ASSOCIATED METHODS FOR FORMING SAME BASF SE (DE) 2023-10-11 EP disclosed
WO-2023192573-A1 METHODS FOR CONVERTING SOLID POLYURETHANE ARTICLES BASF SE (DE) 2023-10-05 WO disclosed
EP-3664984-A1 ISOCYANATE-FUNCTIONAL POLYMER COMPONENTS AND POLYURETHANE ARTICLES FORMED FROM RECYCLED POLYURETHANE ARTICLES AND ASSOCIATED METHODS FOR FORMING SAME BASF SE (DE) 2020-06-17 EP disclosed
WO-2019030071-A1 ISOCYANATE-FUNCTIONAL POLYMER COMPONENTS AND POLYURETHANE ARTICLES FORMED FROM RECYCLED POLYURETHANE ARTICLES AND ASSOCIATED METHODS FOR FORMING SAME BASF SE (DE) 2019-02-14 WO disclosed
WO-2018226838-A1 MULTI-COMPONENT ENGINE COVER BASF SE (DE) 2018-12-13 WO disclosed
EP-3107946-B1 A POLYISO-UREA BASF SE (DE) 2018-08-08 EP disclosed
EP-3298194-A2 METHODS FOR TREATING PAPERBOARDS AND PAPER MEDIA, AND ASSOCIATED PAPERBOARDS AND PAPER MEDIA BASF SE (DE) 2018-03-28 EP disclosed