SCHEMBL15215673

SCHEMBL15215673

Cc1ccc(-c2ccccc2)cc1C1=C(O)CC(CC2CCOCC2)CC1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 2/20 0.36
▸ CNR2 P34972 2/20 0.36
▸ ACACB O00763 3/20 0.35
▸ ACACA Q13085 3/20 0.35
▸ HDAC3 O15379 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ OXTR P30559 2/20 0.34
▸ AVPR1A P37288 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ GPR142 Q7Z601 1/20 0.33
▸ EDNRB P24530 3/20 0.32
▸ EDNRA P25101 3/20 0.32
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ BACE1 P56817 1/20 0.32
▸ CSF1R P07333 1/20 0.32
▸ CYP26A1 O43174 1/20 0.32
▸ HTT P42858 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
SCHEMBL10207892 0.93 ACACB (0.38) ACACBACACAEDNRBEDNRAMAOA
SCHEMBL10207888 0.91 ACACB (0.44) ACACBACACAHDAC1HDAC2EDNRB
SCHEMBL10207911 0.91 HDAC1 (0.38) ACACBACACAHDAC3HDAC1HDAC2
SCHEMBL10207923 0.90 RORC (0.39) ACACBACACAMAPTEDNRBEDNRA
SCHEMBL10207913 0.89 ACACB (0.34) ACACBACACAMAPT
SCHEMBL10207926 0.89 ACACB (0.38) ACACBACACA
SCHEMBL10207912 0.88 ACACB (0.38) ACACBACACAPOLB
SCHEMBL15215687 0.88 ACACB (0.38) ACACBACACAPOLB
SCHEMBL10207929 0.88 ACACB (0.40) ACACBACACA
SCHEMBL10207898 0.88 PIM1 (0.40) —

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-2350034-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2013-08-28 — — EP disclosed
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