SCHEMBL6205934

SCHEMBL6205934

CNCc1ccc(C(=O)OC)cn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.57
KDM4E B2RXH2 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
MAPT P10636 4/20 0.46
ALDH1A1 P00352 2/20 0.45
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
CA12 O43570 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
RAB9A P51151 3/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.43
LOXL2 Q9Y4K0 1/20 0.42
PTGER2 P43116 1/20 0.41
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.40
GABRA5 P31644 1/20 0.40

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
SCHEMBL13637641 0.85 MAPK1 (0.56) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL17252235 0.84 KMT2A (0.44) MAPK1L3MBTL1MAPTALDH1A1RAB9A
SCHEMBL16880702 0.84 MAPK1 (0.54) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL204895 0.83 MAPK1 (0.61) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL1441132 0.83 MAPK1 (0.61) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL29695095 0.83 MAPK1 (0.61) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL2616892 0.83 MAPK1 (0.53) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL20416889 0.81 MAPK1 (0.51) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL880698 0.81 MAPK1 (0.59) MAPK1KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL17298235 0.81 MAPK1 (0.59) MAPK1KDM4EL3MBTL1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506277-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2005-02-16 EP disclosed
WO-2003097780-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2003-11-27 WO disclosed
EP-1341893-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2003-09-10 EP disclosed
WO-2002048307-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2002-06-20 WO disclosed
CN-1351646-A Composition and method for bleaching a substrate UNILEVER PLC (NL) 2002-05-29 CN disclosed