SCHEMBL14698472

SCHEMBL14698472

Fc1ccccc1-c1ccc2c(n1)CCCC2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
MPL P40238 1/20 0.40
MAP4K1 Q92918 2/20 0.38
ADRA2A P08913 3/20 0.38
ADRA2B P18089 3/20 0.38
ADRA2C P18825 3/20 0.38
PARP1 P09874 1/20 0.38
IDO1 P14902 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36

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
SCHEMBL11645036 0.80 CDK5 (0.44) ADRA2AADRA2BADRA2CIDO1ALDH1A1
SCHEMBL17984845 0.78 CYP3A4 (0.46) NPC1MPLMAP4K1IDO1SMN1; SMN2
SCHEMBL29648993 0.78 ADRA2A (0.50) NPC1ADRA2AADRA2BADRA2CALDH1A1
SCHEMBL3310894 0.75 MEN1 (0.45) NPC1ADRA2AADRA2BADRA2CALDH1A1
SCHEMBL1385607 0.74 NPC1 (0.38) NPC1MPLIDO1ALDH1A1LMNA
SCHEMBL1383964 0.74 NPC1 (0.38) NPC1MPLIDO1ALDH1A1LMNA
SCHEMBL31598494 0.74 MEN1 (0.44) NPC1ADRA2AADRA2BADRA2CALDH1A1
SCHEMBL3869454 0.72 KMT2A (0.41) NPC1ADRA2AADRA2BADRA2CALDH1A1
SCHEMBL20341749 0.72 KDM1A (0.45) NPC1ALDH1A1MAPT
SCHEMBL17984846 0.71 MEN1 (0.54) NPC1ALDH1A1MAPTSMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9040704-B2 Fluorescent dyes with large stokes shifts UTI LIMITED PARTNERSHIP (CA) 2015-05-26 US disclosed
US-20140206870-A1 FLUORSCENT DYES WITH LARGE STOKES SHIFTS UTI LIMITED PARTNERSHIP (CA) 2014-07-24 US disclosed
WO-2013023292-A1 FLUORESCENT DYES WITH LARGE STOKES SHIFTS UTI LIMITED PARTNERSHIP (CA) 2013-02-21 WO disclosed