SCHEMBL19418359

SCHEMBL19418359

Cc1ccc(N(c2ccc(Sc3ccc(N(c4ccc(C(C)(C)C)cc4)c4ccc(C(C)(C)C)cc4)cc3)cc2)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
MLYCD O95822 1/20 0.47
HCRTR2 O43614 1/20 0.42
PTGIR P43119 2/20 0.40
MAPT P10636 3/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ALDH1A1 P00352 4/20 0.38
NPSR1 Q6W5P4 2/20 0.38
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
HPGD P15428 1/20 0.35
LMNA P02545 1/20 0.34
TYR P14679 1/20 0.34
KIF11 P52732 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
GAA P10253 1/20 0.34
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33

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
SCHEMBL20902510 0.92 PTGIR (0.44) TSHRMLYCDHCRTR2PTGIRMAPT
SCHEMBL12733318 0.88 TSHR (0.71) TSHRMLYCDPTGIRMAPTNPC1
SCHEMBL16682899 0.88 TSHR (0.71) TSHRHCRTR2MAPTNPC1RAB9A
SCHEMBL11994079 0.88 TSHR (0.71) TSHRHCRTR2MAPTNPC1RAB9A
SCHEMBL13322018 0.88 TSHR (0.71) TSHRHCRTR2MAPTNPC1RAB9A
SCHEMBL19996361 0.88 TSHR (0.71) TSHRHCRTR2MAPTNPC1RAB9A
SCHEMBL24133973 0.86 ALDH1A1 (0.46) TSHRMLYCDPTGIRMAPTNPC1
SCHEMBL8943645 0.86 ALDH1A1 (0.46) TSHRMLYCDPTGIRMAPTNPC1
SCHEMBL12374363 0.82 TSHR (0.62) TSHRHCRTR2MAPTNPC1RAB9A
SCHEMBL13751266 0.82 TSHR (0.62) TSHRHCRTR2MAPTNPC1RAB9A

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
EP-3226320-A1 ORGANIC ELECTROLUMINESCENT DEVICE Beijing Visionox Technology Co., Ltd. (CN) 2017-10-04 EP disclosed