SCHEMBL11564384

SCHEMBL11564384

CC1(C(=O)Nc2ccc(OCC3CC3)cc2)CC1Cl

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.47
PARP15 Q460N3 3/20 0.46
PARP10 Q53GL7 3/20 0.46
PARP2 Q9UGN5 2/20 0.46
NR1H4 Q96RI1 1/20 0.43
ACACB O00763 3/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
P2RX3 P56373 1/20 0.41
ADAM17 P78536 1/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TP53 P04637 1/20 0.41
PKM P14618 1/20 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
SCHEMBL11435809 0.88 CNR2 (0.48) CNR2PARP15PARP10PARP2NR1H4
SCHEMBL11562800 0.85 CNR2 (0.64) CNR2NPC1LMNARAB9ASMN1; SMN2
SCHEMBL11565894 0.83 CNR2 (0.44) CNR2PARP15PARP10PARP2NR1H4
SCHEMBL11566098 0.81 TSHR (0.54) NPC1LMNARAB9ASMN1; SMN2TP53
SCHEMBL11566480 0.77 GLA (0.54) CNR2NPC1LMNARAB9ASMN1; SMN2
SCHEMBL1858579 0.76 PARP15 (0.57) PARP15PARP10PARP2NR1H4FNTA
SCHEMBL13652527 0.75 POLB (0.55) PARP15PARP10PARP2NR1H4ACACB
SCHEMBL11566982 0.73 MAPT (0.50) CNR2NR1H4ACACBNPC1LMNA
SCHEMBL11439260 0.72 CNR2 (0.64) CNR2NPC1LMNARAB9ATP53
SCHEMBL11565937 0.72 CNR2 (0.64) CNR2NPC1LMNARAB9ASMN1; SMN2

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
US-4166735-A Cycloalkanecarboxanilide derivative herbicides SHELL OIL COMPANY (US) 1979-09-04 US disclosed