SCHEMBL12110697

SCHEMBL12110697

CCC(C)(C)C(=O)Oc1ccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.44
RAB9A P51151 5/20 0.43
NPSR1 Q6W5P4 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 5/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 1/20 0.41
SERPINE1 P05121 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
RIPK1 Q13546 2/20 0.39
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SRD5A1 P18405 1/20 0.38

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
SCHEMBL10025411 0.96 ELANE (0.48) ELANERAB9ANPSR1MEN1KMT2A
SCHEMBL10025410 0.90 LTB4R2 (0.41) ELANERAB9ANPSR1MEN1KMT2A
SCHEMBL683318 0.90 ELANE (0.50) ELANERAB9ANPSR1MEN1KMT2A
SCHEMBL21131904 0.89 ELANE (0.40) ELANERAB9ANPSR1MEN1KMT2A
SCHEMBL14411143 0.84 LTB4R2 (0.37) ELANERAB9ANPC1ALDH1A1MAPT
SCHEMBL131278 0.83 ELANE (0.51) ELANENPSR1MAPTRIPK1ATM
SCHEMBL21131899 0.83 ELANE (0.48) ELANERAB9ANPSR1MEN1KMT2A
SCHEMBL13979421 0.82 ELANE (0.51) ELANEMEN1KMT2A
SCHEMBL12445029 0.81 ALDH1A1 (0.42) RAB9ANPC1ALDH1A1MAPTRIPK1
SCHEMBL14827287 0.80 ELANE (0.58) ELANERAB9ANPSR1MEN1KMT2A

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-8053024-B2 Method for manufacturing organic electroluminescent device KONICA MINOLTA HOLDINGS, INC. (JP) 2011-11-08 US disclosed
US-20090081357-A1 METHOD FOR MANUFACTURING ORGANIC ELECTROLUMINESCENT DEVICE KONICA MINOLTA HOLDINGS, INC. (JP) 2009-03-26 US disclosed