SCHEMBL29677645

SCHEMBL29677645

CCn1c2ccc(C=O)cc2c2cc(C=Cc3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)ccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 5/20 0.54
KDM4E B2RXH2 5/20 0.43
HTT P42858 3/20 0.43
POLB P06746 2/20 0.43
PKM P14618 1/20 0.43
BCHE P06276 3/20 0.43
ACHE P22303 3/20 0.43
SRC P12931 2/20 0.42
ALDH1A1 P00352 6/20 0.41
HPGD P15428 6/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
LMNA P02545 4/20 0.41
MAPT P10636 4/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
HSD17B10 Q99714 2/20 0.40
USP2 O75604 1/20 0.40
TSHR P16473 1/20 0.40
CASP1 P29466 1/20 0.40
TSPO P30536 1/20 0.37

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
SCHEMBL28567473 1.00 PTGER4 (0.54) PTGER4KDM4EHTTPOLBPKM
SCHEMBL28572883 0.96 PTGER4 (0.58) PTGER4KDM4EHTTPOLBPKM
SCHEMBL29677329 0.96 PTGER4 (0.58) PTGER4KDM4EHTTPOLBPKM
SCHEMBL28568970 0.93 PTGER4 (0.56) PTGER4KDM4EHTTPOLBPKM
SCHEMBL29677533 0.93 PTGER4 (0.56) PTGER4KDM4EHTTPOLBPKM
SCHEMBL31021117 0.89 PTGER4 (0.60) PTGER4KDM4EHTTPOLBPKM
SCHEMBL29677444 0.87 APP (0.52) PTGER4KDM4EHTTPOLBPKM
SCHEMBL28576490 0.87 PTGER4 (0.45) PTGER4KDM4ESMN1; SMN2MAPTTDP1
SCHEMBL29677403 0.87 PTGER4 (0.45) PTGER4KDM4ESMN1; SMN2MAPTTDP1
SCHEMBL29677283 0.83 PTGER4 (0.47) PTGER4SMN1; SMN2MAPTTDP1

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
CN-112898799-B Carbazole organic dye and preparation method thereof, dye-sensitized titanium dioxide composite catalyst and preparation method and application thereof 江苏大学 2022-07-15 CN disclosed