SCHEMBL8977550

SCHEMBL8977550

N#Cc1ccc(-c2ccccc2NCCCO)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 1/20 0.45
STAT3 P40763 1/20 0.42
ALDH1A1 P00352 4/20 0.42
MAPT P10636 3/20 0.42
KDM4E B2RXH2 2/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
QPCT Q16769 2/20 0.40
CHRM3 P20309 1/20 0.39
LMNA P02545 3/20 0.39
HTT P42858 2/20 0.39
CDC25A P30304 1/20 0.39
POLB P06746 2/20 0.39
RAD52 P43351 2/20 0.39
NSD2 O96028 1/20 0.38
FGB P02675 1/20 0.38
MMP14 P50281 1/20 0.38
MEN1 O00255 1/20 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
SCHEMBL15517701 0.82 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EGAAHPGD
Hydrochloric Acid SCHEMBL28052967 0.80 ALDH1A1 (0.49) ALDH1A1MAPTKDM4EGAAHPGD
SCHEMBL7770001 0.80 STAT3 (0.48) STAT3ALDH1A1MAPTKDM4EGAA
SCHEMBL8977551 0.78 MERTK (0.49) MERTKALDH1A1TSHRHSD17B10MMP3
SCHEMBL7522731 0.76 KDM4E (0.54) ALDH1A1MAPTKDM4EGAAHPGD
SCHEMBL2963239 0.75 MERTK (0.52) MERTKALDH1A1MAPTKDM4EGAA
SCHEMBL3787398 0.73 ALDH1A1 (0.46) MERTKALDH1A1TSHRHSD17B10MMP3
SCHEMBL9551853 0.72 CHRM3 (0.48) STAT3ALDH1A1MAPTKDM4EHPGD
SCHEMBL31463164 0.72 TSHR (0.57) ALDH1A1TSHRMMP3
SCHEMBL22712390 0.72 QPCT (0.53) STAT3ALDH1A1MAPTQPCTLMNA

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
EP-0463931-B1 Amorphous copolymers, translucent to visible light, for applications in non linear optics THOMSON CSF (FR) 1996-04-24 EP claimed
US-5264512-A Amorphous copolymers, transparent in the visible range, for non-linear optical applications THOMSON-CSF (FR) 1993-11-23 US disclosed