SCHEMBL10414749

SCHEMBL10414749

[CH2]c1ccc(N(C)C)cc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
TSHR P16473 4/20 0.43
ALOX15 P16050 2/20 0.43
HSD17B10 Q99714 1/20 0.43
APP P05067 3/20 0.40
TERT O14746 1/20 0.40
KCNH2 Q12809 2/20 0.36
MAT2A P31153 1/20 0.36
CYP3A4 P08684 2/20 0.36
MAPK1 P28482 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
TP53 P04637 1/20 0.36
KDM4E B2RXH2 1/20 0.35
KMT2A Q03164 3/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MAPT P10636 1/20 0.33
EGFR P00533 2/20 0.32
MEN1 O00255 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7692723 0.78 ALDH1A1 (0.50) ALDH1A1TSHRALOX15HSD17B10APP
SCHEMBL5644465 0.74 ALDH1A1 (0.46) ALDH1A1TSHRALOX15HSD17B10APP
SCHEMBL21359219 0.74 MAPT (0.47) ALDH1A1TSHRALOX15HSD17B10APP
SCHEMBL5640688 0.74 ALDH1A1 (0.46) ALDH1A1TSHRALOX15HSD17B10APP
SCHEMBL19425812 0.74 ALDH1A1 (0.46) ALDH1A1TSHRALOX15HSD17B10APP
SCHEMBL23089861 0.73 ALDH1A1 (0.43) ALDH1A1TSHRALOX15HSD17B10APP
SCHEMBL28537509 0.73 ALDH1A1 (0.43) ALDH1A1TSHRALOX15HSD17B10APP
SCHEMBL1041171 0.73 ALDH1A1 (0.43) ALDH1A1TSHRALOX15HSD17B10APP
SCHEMBL9322910 0.73 ALDH1A1 (0.43) ALDH1A1TSHRALOX15HSD17B10APP
SCHEMBL7744331 0.73 ALDH1A1 (0.50) ALDH1A1TSHRALOX15HSD17B10APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4963566-A ANTIULCER AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-10-16 US disclosed