SCHEMBL9720010

SCHEMBL9720010

O=C(Oc1ccccc1)Oc1ccc2c(c1)CCCC2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.55
ALOX15 P16050 1/20 0.55
HSD17B10 Q99714 1/20 0.55
MAPK14 Q16539 1/20 0.48
RXRB P28702 4/20 0.48
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
RXRA P19793 3/20 0.48
RXRG P48443 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
STS P08842 1/20 0.47
PPARG P37231 2/20 0.47
PPARD Q03181 1/20 0.47
POLB P06746 2/20 0.45
GFER P55789 1/20 0.45
PAX8 Q06710 1/20 0.45
KLF5 Q13887 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ALDH1A1 P00352 2/20 0.44

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
SCHEMBL9719992 0.91 ALOX15 (0.59) TSHRALOX15HSD17B10RXRBNPC1
SCHEMBL11653596 0.88 SMN1; SMN2 (0.58) TSHRALOX15HSD17B10RXRBNPC1
SCHEMBL11067870 0.82 ALOX15 (0.62) TSHRALOX15HSD17B10RXRBNPC1
SCHEMBL9720000 0.82 KMT2A (0.58) TSHRALOX15HSD17B10RXRBNPC1
SCHEMBL7336195 0.81 PPARG (0.53) TSHRALOX15HSD17B10RXRBNPC1
SCHEMBL6890990 0.79 SMN1; SMN2 (0.54) TSHRALOX15HSD17B10RXRBNPC1
SCHEMBL875632 0.79 ALOX15 (0.57) TSHRALOX15HSD17B10RXRBNPC1
SCHEMBL6890994 0.78 POLB (0.54) TSHRALOX15HSD17B10NPC1RAB9A
Cyclohexane SCHEMBL23214149 0.78 ALDH1A1 (0.53) ALOX15HSD17B10RAB9ASMN1; SMN2PPARG
SCHEMBL1624304 0.78 KMT2A (0.52) ALOX15HSD17B10PPARGL3MBTL1ALDH1A1

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