SCHEMBL28801757

SCHEMBL28801757

NN(C(=O)C1=Cc2cc3cc4cc5ccccc5cc4cc3cc2CC1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.32
ATR Q13535 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
PLAU P00749 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30

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
SCHEMBL30277227 0.79 ALDH1A1 (0.42) IDO1KDM4EALDH1A1GAAPLAU
SCHEMBL26080873 0.77 IDO1 (0.41) IDO1KDM4EALDH1A1
SCHEMBL9769555 0.66 NPSR1 (0.52) ATRKDM4EALDH1A1GAANPSR1
SCHEMBL11848661 0.65 ESR1 (0.59) KDM4EALDH1A1PLAUESR1ESR2
SCHEMBL12658256 0.65 HPGD (0.45) IDO1ATRKDM4EALDH1A1GAA
SCHEMBL30762289 0.64 MEN1 (0.36) IDO1KDM4EALDH1A1GAA
SCHEMBL11833560 0.64 NR4A1 (0.58) ATRKDM4EALDH1A1NPSR1
SCHEMBL3417761 0.63 CYP11B2 (0.44)
Hydrochloric Acid SCHEMBL11865419 0.62 NR4A1 (0.56) ATRKDM4EALDH1A1NPSR1
SCHEMBL2929882 0.62 MEN1 (0.48) KDM4EALDH1A1GAA

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
CN-103045232-B Dihydro-pentacene-olefin organic light-emitting material, preparation method and application of dihydro-pentacene-olefin organic light-emitting material JILIN OLED OPTICAL AND ELECTRONIC MATERIALS CO LTD 2014-07-23 CN disclosed
CN-103045232-A Dihydro-pentacene-olefin organic light-emitting material, preparation method and application of dihydro-pentacene-olefin organic light-emitting material JILIN OPTICAL & ELECTRONIC MATERIALS CO LTD 2013-04-17 CN disclosed