SCHEMBL7227225

SCHEMBL7227225

CCC(C)(C)c1ccc(OC(C)[O])c(C(C)(C)CC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 6/20 0.53
SMN1; SMN2 Q16637 5/20 0.53
NPSR1 Q6W5P4 5/20 0.53
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
ALDH1A1 P00352 1/20 0.53
MAPT P10636 5/20 0.46
HTT P42858 3/20 0.46
UBE2N P61088 2/20 0.46
GLA P06280 1/20 0.46
MITF O75030 1/20 0.46
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
ATM Q13315 2/20 0.43
LMNA P02545 1/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
RAD52 P43351 2/20 0.42

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
SCHEMBL5489761 0.84 MAPK1 (0.50) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL7107870 0.84 MAPK1 (0.50) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL6536663 0.84 MAPK1 (0.50) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL5145846 0.84 MAPK1 (0.50) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL28378701 0.82 MAPK1 (0.55) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL8980027 0.82 MAPK1 (0.48) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL10706504 0.81 MAPK1 (0.54) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL10634380 0.81 MAPK1 (0.54) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL7061883 0.81 MAPK1 (0.48) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL8961897 0.81 MAPK1 (0.48) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030190568-A1 Thermally developable photosensitive material FUJIFILM CORPORATION (JP) 2003-10-09 US disclosed
US-6280922-B1 IN COMBINATION WITH CERTAIN MERCAPTO AZOLE COMPOUNDS. EASTMAN KODAK COMPANY 2001-08-28 US disclosed