SCHEMBL9720000

SCHEMBL9720000

O=C(Oc1ccc2c(c1)CCCC2)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.58
MAPT P10636 4/20 0.58
MEN1 O00255 3/20 0.58
TDP1 Q9NUW8 2/20 0.58
MAOA P21397 1/20 0.56
MAOB P27338 1/20 0.56
HSD17B10 Q99714 2/20 0.54
ALOX15 P16050 1/20 0.54
TSHR P16473 1/20 0.54
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
POLB P06746 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
GRM5 P41594 1/20 0.50
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
RXRG P48443 1/20 0.50
PARP10 Q53GL7 1/20 0.50
GFER P55789 1/20 0.50
PAX8 Q06710 1/20 0.50

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
SCHEMBL9720010 0.82 TSHR (0.55) KMT2AMAPTMEN1HSD17B10ALOX15
SCHEMBL16882860 0.81 ALDH1A1 (0.55) KMT2AMAPTMEN1TDP1HSD17B10
SCHEMBL11067870 0.81 ALOX15 (0.62) MAPTTDP1HSD17B10ALOX15TSHR
SCHEMBL16882870 0.81 NPC1 (0.52) KMT2AMAPTMEN1TDP1HSD17B10
SCHEMBL14870639 0.80 GRM5 (0.63) KMT2AMAPTMEN1TDP1MAOA
SCHEMBL9719992 0.79 ALOX15 (0.59) MAPTTDP1HSD17B10ALOX15TSHR
SCHEMBL875632 0.78 ALOX15 (0.57) MAPTHSD17B10ALOX15TSHRNPC1
SCHEMBL3591812 0.77 KMT2A (0.54) KMT2AMAPTMEN1TDP1MAOA
SCHEMBL2921166 0.77 GRM5 (0.64) KMT2AMAPTMEN1TDP1MAOA
SCHEMBL27491050 0.77 KMT2A (0.54) KMT2AMAPTMEN1TDP1MAOA

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-5081099-A A tetrahydronaphthalene sensitizer as antifogging agent; storage stability ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1992-01-14 US disclosed