SCHEMBL8105644

SCHEMBL8105644

CCc1ccccc1-c1cc(O)cc(=O)o1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 1/20 0.46
HSD17B3 P37058 2/20 0.43
SLC9A1 P19634 1/20 0.43
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
CYP3A4 P08684 3/20 0.42
GLA P06280 1/20 0.42
ELAVL1 Q15717 1/20 0.42
HPGD P15428 3/20 0.40
GABRA1 P14867 3/20 0.40
GABRB2 P47870 3/20 0.40
ALDH1A1 P00352 2/20 0.40
POLB P06746 2/20 0.40
GABRP O00591 2/20 0.40
GABRD O14764 2/20 0.40
GABRB1 P18505 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA5 P31644 2/20 0.40
GABRA3 P34903 2/20 0.40

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
SCHEMBL8109864 0.80 ATM (0.54) HSD17B3SLC9A1MEN1KMT2ACYP3A4
SCHEMBL1008973 0.78 MEN1 (0.60) MEN1KMT2AHPGDGABRA1GABRB2
SCHEMBL6827384 0.77 ALDH1A1 (0.60) SLC9A1MEN1KMT2ACYP3A4GLA
SCHEMBL8107451 0.77 MAOB (0.49) MEN1KMT2ACYP3A4GLAELAVL1
SCHEMBL30568046 0.74 SHBG (0.51) HSD17B3MEN1KMT2AHPGDTP53
SCHEMBL20473368 0.74 SHBG (0.51) HSD17B3MEN1KMT2AHPGDTP53
SCHEMBL17128801 0.74 MEN1 (0.43) HSD17B3MEN1KMT2ACYP3A4HPGD
SCHEMBL27806529 0.74 HPGD (0.67) MEN1KMT2ACYP3A4GLAHPGD
SCHEMBL29129672 0.73 MAPT (0.55) MEN1KMT2ACYP3A4HPGDGABRA1
SCHEMBL8121356 0.72 QPCT (0.59) MAPKAPK2HSD17B3MEN1KMT2ACYP3A4

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
US-6114546-A Aminomethylene derivatives and ultraviolet absorbent comprising thereof CHEMIPRO KASEI KAISHA, LIMITED (JP) 2000-09-05 US disclosed
EP-0950655-A1 AMINOMETHYLENE DERIVATIVES AND ULTRAVIOLET ABSORBER COMPRISING THE SAME CHEMIPRO KASEI KAISHA, LIMITED (JP) 1999-10-20 EP disclosed