SCHEMBL27479676

SCHEMBL27479676

CC(Oc1cc[c]cc1)c1nc2ccccc2s1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.64
▸ TSHR P16473 2/20 0.49
▸ GAA P10253 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ LOXL2 Q9Y4K0 1/20 0.49
▸ SLC6A4 P31645 1/20 0.45
▸ HPGD P15428 2/20 0.43
▸ CASR P41180 1/20 0.43
▸ ALOX5 P09917 1/20 0.43
▸ MAPK9 P45984 2/20 0.43
▸ MAPK10 P53779 2/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ NFKB1 P19838 2/20 0.42
▸ NFKB2 Q00653 2/20 0.42
▸ RELA Q04206 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ PKM P14618 2/20 0.41

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
SCHEMBL7543912 0.76 RAB9A (0.72) RAB9ATSHRGAAMAPK1HPGD
SCHEMBL7544139 0.76 RAB9A (0.69) RAB9ATSHRGAAMAPK1HPGD
SCHEMBL7542527 0.74 RAB9A (0.53) RAB9ATSHRGAAMAPK1LOXL2
SCHEMBL2146969 0.72 LOXL2 (0.66) RAB9ATSHRGAAMAPK1LOXL2
SCHEMBL62420 0.72 LOXL2 (0.66) RAB9ATSHRGAAMAPK1LOXL2
SCHEMBL27706611 0.72 RAB9A (0.54) RAB9ATSHRGAAMAPK1LOXL2
SCHEMBL9675088 0.71 LOXL2 (0.64) RAB9ATSHRGAAMAPK1LOXL2
SCHEMBL4465201 0.71 CYP1A2 (0.60) SMN1; SMN2
SCHEMBL21318392 0.70 LOXL2 (0.62) RAB9ATSHRGAAMAPK1LOXL2
SCHEMBL21275558 0.70 LOXL2 (0.62) RAB9ATSHRGAAMAPK1LOXL2

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
CN-1176962-A Aniline derivatives having herbicidal activity their prepn. and their use SANKYO CO (JP) 1998-03-25 — — CN disclosed
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