SCHEMBL799434

SCHEMBL799434

CCC(C)CN(Cc1ccccc1)C(C)=O

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ALDH1A1 P00352 2/20 0.45
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
CHRM2 P08172 1/20 0.44
CHRM4 P08173 1/20 0.44
CHRM5 P08912 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
HPGD P15428 1/20 0.43
PTGES O14684 2/20 0.43
NPSR1 Q6W5P4 1/20 0.42
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TSPO P30536 1/20 0.42
FOLH1 Q04609 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
SCHEMBL24762818 0.84 LMNA (0.49) LMNAMEN1KMT2AALDH1A1TSHR
SCHEMBL24762976 0.84 LMNA (0.49) LMNAMEN1KMT2AALDH1A1TSHR
SCHEMBL24763238 0.84 LMNA (0.49) LMNAMEN1KMT2AALDH1A1TSHR
SCHEMBL799690 0.82 NPC1 (0.47) LMNAMEN1KMT2AALDH1A1TSHR
SCHEMBL2117209 0.80 LMNA (0.62) LMNAMEN1KMT2AALDH1A1TSHR
SCHEMBL3836681 0.79 LMNA (0.72) LMNAMEN1KMT2AALDH1A1TSHR
SCHEMBL18531386 0.78 LMNA (0.45) LMNAMEN1KMT2AALDH1A1TSHR
SCHEMBL3662061 0.76 LMNA (0.58) LMNAMEN1KMT2AALDH1A1TSHR
SCHEMBL1059560 0.75 LMNA (0.56) LMNAMEN1KMT2AALDH1A1TSHR
SCHEMBL12511815 0.75 ACKR3 (0.41) MEN1KMT2AALDH1A1TSHRL3MBTL1

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-8672466-B2 Ink composition, ink set and image forming method FUJIFILM CORPORATION (JP) 2014-03-18 US disclosed
US-20120069084-A1 INK COMPOSITION, INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2012-03-22 US disclosed