SCHEMBL8942783

SCHEMBL8942783

CCCCCCCCCCCCCCCCCCOC(=O)c1[c]c2ccccc2cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
TSHR P16473 4/20 0.56
LMNA P02545 3/20 0.56
MAPK1 P28482 2/20 0.54
TP53 P04637 1/20 0.54
CYP3A4 P08684 1/20 0.54
KDM4E B2RXH2 2/20 0.50
HSD17B10 Q99714 2/20 0.50
POLB P06746 1/20 0.50
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NPC1 O15118 1/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
MMP2 P08253 1/20 0.44
CNR2 P34972 1/20 0.43
MMP1 P03956 1/20 0.43
MMP9 P14780 1/20 0.43
MMP12 P39900 1/20 0.43
ESR1 P03372 3/20 0.43

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
SCHEMBL22263841 1.00 ALDH1A1 (0.56) ALDH1A1TSHRLMNAMAPK1TP53
SCHEMBL22263901 1.00 ALDH1A1 (0.56) ALDH1A1TSHRLMNAMAPK1TP53
SCHEMBL22263931 0.99 TSHR (0.55) ALDH1A1TSHRLMNAMAPK1TP53
SCHEMBL4629883 0.94 TSHR (0.54) ALDH1A1TSHRLMNAMAPK1TP53
SCHEMBL4722815 0.89 ALDH1A1 (0.51) ALDH1A1TSHRLMNAMAPK1TP53
SCHEMBL2323796 0.83 TSHR (0.49) ALDH1A1TSHRLMNAMAPK1KDM4E
SCHEMBL4723198 0.83 TSHR (0.50) ALDH1A1TSHRLMNAMAPK1TP53
SCHEMBL7196364 0.77 ESR1 (0.51) ALDH1A1TSHRLMNAMAPK1CYP3A4
SCHEMBL4721065 0.77 ALDH1A1 (0.47) ALDH1A1TSHRLMNAMAPK1TP53
SCHEMBL294061 0.76 ALDH1A1 (0.53) ALDH1A1TSHRLMNATP53KDM4E

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-5514532-A HYDRAZIDE COMPOUNDS WHICH RELEASES PYRAZOLOAZOLE OR INDAZOLONE COLOR REVERSAL FUJI PHOTO FILM CO., LTD. (JP) 1996-05-07 US disclosed
EP-0554778-B1 Silver halide color photographic material FUJI PHOTO FILM CO LTD (JP) 1995-05-31 EP disclosed
EP-0554778-A1 Silver halide color photographic material FUJI PHOTO FILM CO., LTD. (JP) 1993-08-11 EP disclosed