SCHEMBL9769309

SCHEMBL9769309

CCCCC[CH]Oc1cc(C(C)(C)CC)ccc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.36
CNR1 P21554 5/20 0.36
MAPK1 P28482 5/20 0.33
SMN1; SMN2 Q16637 5/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
LMNA P02545 1/20 0.33
CASP3 P42574 1/20 0.33
ATM Q13315 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
NPSR1 Q6W5P4 4/20 0.32
MAPT P10636 4/20 0.32
HTT P42858 3/20 0.32
UBE2N P61088 2/20 0.32
GLA P06280 1/20 0.32
MITF O75030 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
SCHEMBL9770228 0.85 ACACB (0.36) CNR2CNR1MAPK1SMN1; SMN2NPC1
SCHEMBL7454444 0.81 MAPK1 (0.45) CNR2CNR1MAPK1SMN1; SMN2NPC1
SCHEMBL5394859 0.78 MAPK1 (0.47) CNR2CNR1MAPK1SMN1; SMN2NPC1
SCHEMBL9769331 0.77 CNR2 (0.44) CNR2CNR1
SCHEMBL9770022 0.75 MAPK1 (0.34) MAPK1SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL9769326 0.75 SMN1; SMN2 (0.36) CNR2CNR1MAPK1SMN1; SMN2LMNA
SCHEMBL24486537 0.75 ALDH1A1 (0.44) CNR2CNR1MAPK1SMN1; SMN2NPC1
SCHEMBL9769414 0.72 CNR2 (0.36) CNR2CNR1MAPK1SMN1; SMN2LMNA
SCHEMBL9769416 0.72 CNR2 (0.46) CNR2CNR1
SCHEMBL9770233 0.71 SMN1; SMN2 (0.49) MAPK1SMN1; SMN2NPC1RAB9AMEN1

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-4994209-A Optically transparent solid solution of organic compound in polymer FUJI PHOTO FILM CO., LTD. (JP) 1991-02-19 US disclosed