SCHEMBL22129807

SCHEMBL22129807

Cc1cccc(C(=O)OO)c1C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 2/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
CYP2C9 P11712 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
TSHR P16473 1/20 0.36
MYC P01106 1/20 0.36
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL1348862 0.89 MAPT (0.39) ALDH1A1HSD17B10KMT2ANPC1POLB
SCHEMBL12593308 0.86 CA1 (0.49) KDM4EALDH1A1HSD17B10KMT2AMEN1
SCHEMBL4737878 0.82 ALOX15 (0.43) KDM4EALDH1A1HPGDHSD17B10ESR1
SCHEMBL220621 0.82 CA2 (0.41) KDM4EALDH1A1KMT2ANPC1POLB
SCHEMBL22023652 0.81 PARP1 (0.42) KDM4EALDH1A1HPGDHSD17B10NPC1
SCHEMBL1524133 0.81 TSHR (0.39) ALDH1A1HPGDKMT2AESR1ESR2
SCHEMBL8174194 0.81 CA2 (0.39) KDM4EALDH1A1KMT2ANPC1POLB
SCHEMBL11177188 0.81 MAPT (0.34) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL11930069 0.79 ALDH1A1 (0.57) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL29425576 0.78 TSHR (0.39) ALDH1A1HPGDHSD17B10KMT2AMEN1

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
WO-2021125412-A1 DEFECT-SUPPRESSED METAL HALIDE PEROVSKITE LUMINESCENT MATERIAL, AND LIGHT-EMITTING DIODE COMPRISING SAME 서울대학교산학협력단 2021-06-24 WO disclosed
WO-2020130592-A1 METAL HALIDE PEROVSKITE LIGHT EMITTING DEVICE AND METHOD FOR MANUFACTURING SAME 서울대학교산학협력단 2020-06-25 WO disclosed