SCHEMBL9769334

SCHEMBL9769334

[CH2]Oc1cc(C(C)(C)CC)ccc1C(C)(C)CC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 6/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
NPSR1 Q6W5P4 5/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 5/20 0.41
HTT P42858 3/20 0.41
UBE2N P61088 2/20 0.41
GLA P06280 1/20 0.41
MITF O75030 1/20 0.41
RAB9A P51151 4/20 0.40
NPC1 O15118 3/20 0.40
LMNA P02545 1/20 0.40
CASP3 P42574 1/20 0.40
ATM Q13315 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
RAD52 P43351 2/20 0.37

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
SCHEMBL5143992 0.86 MAPK1 (0.46) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL988255 0.86 MAPK1 (0.55) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL6759090 0.80 MAPK1 (0.46) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL8765578 0.79 MAPK1 (0.48) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL9769316 0.79 MAPK1 (0.43) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL6702685 0.79 MAPK1 (0.48) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL8943330 0.78 MAPK1 (0.45) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL6759089 0.78 MAPK1 (0.42) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL6536662 0.78 MAPK1 (0.45) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL8761422 0.78 MAPK1 (0.45) MAPK1SMN1; SMN2NPSR1MEN1KMT2A

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