SCHEMBL8638641

SCHEMBL8638641

Cc1ccc(-c2[c]ccc3c2OCO3)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.39
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
KDM4E B2RXH2 3/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
MAPK1 P28482 3/20 0.34
HPGD P15428 3/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
LMNA P02545 2/20 0.34
GAA P10253 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
MAP2K4 P45985 1/20 0.32
MAPKAPK2 P49137 1/20 0.32
MAPKAPK3 Q16644 1/20 0.32

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
SCHEMBL8212957 0.83 ABCG2 (0.40) MAPTSMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL161183 0.82 ABCG2 (0.39) ALDH1A1TSHRHSD17B10NQO2CYP19A1
SCHEMBL9738660 0.80 KDM4E (0.41) MAPTALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL9740282 0.80 RIPK3 (0.37) MAPTALDH1A1KDM4ELMNAGAA
SCHEMBL11571390 0.78 PREP (0.43) MAPTALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL6210971 0.76 PDE4A (0.41) MAPTALDH1A1NPC1RAB9AMAPK1
SCHEMBL6784931 0.75 HSP90AA1 (0.30) HSP90AA1HSP90AB1
SCHEMBL83574 0.74 NQO2 (0.40) ALDH1A1LMNAGAATSHRNQO2
SCHEMBL15377351 0.73 ALOX5 (0.45) MAPTALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL4807540 0.73 MAPT (0.49) MAPTALDH1A1SMN1; SMN2KDM4ENPC1

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
EP-0651737-B1 O-BENZYL OXIME ETHER DERIVATIVES AND THEIR USE AS PESTICIDES CIBA GEIGY AG (CH) 1998-07-29 EP claimed