SCHEMBL16352575

SCHEMBL16352575

O=[N+]([O-])c1ccccc1-c1cc2c(nc(-c3ccccc3)n2-c2ccccc2)c2c3ccccc3n(-c3ccccc3)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.40
▸ HTT P42858 2/20 0.40
▸ SIRT2 Q8IXJ6 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ DCTPP1 Q9H773 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ GUSB P08236 1/20 0.35
▸ F2 P00734 1/20 0.35
▸ C1R P00736 1/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.34
▸ CRHBP P24387 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ ADORA1 P30542 1/20 0.34
▸ LMNA P02545 3/20 0.34
▸ RXFP1 Q9HBX9 2/20 0.34

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
SCHEMBL16352424 0.84 ESR1 (0.40) ALDH1A1HTTMAPTMEN1KMT2A
SCHEMBL16352513 0.81 ALDH1A1 (0.48) ALDH1A1HTTSIRT2TDP1DCTPP1
SCHEMBL16352469 0.79 MAPT (0.42) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL16352570 0.78 DCTPP1 (0.44) ALDH1A1HTTSIRT2TDP1DCTPP1
SCHEMBL16352451 0.78 MAPT (0.44) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL16352450 0.76 KDM4E (0.42) ALDH1A1POLBMAPTMEN1KMT2A
SCHEMBL16352571 0.76 ESR1 (0.39) ALDH1A1DCTPP1MAPTMEN1KMT2A
SCHEMBL29959680 0.76 ALDH1A1 (0.50) ALDH1A1HTTSIRT2TDP1POLB
SCHEMBL26693461 0.76 ALDH1A1 (0.50) ALDH1A1HTTSIRT2TDP1POLB
SCHEMBL17861293 0.75 KDM4E (0.46) ALDH1A1TDP1POLBMAPTMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9419229-B2 Compound, organic optoelectric device including the same and display device including the optoelectric device CHEIL INDUSTRIES, INC. (KR) 2016-08-16 — — US disclosed
US-9419229-B2 Compound, organic optoelectric device including the same and display device including the optoelectric device CHEIL INDUSTRIES, INC. (KR) 2016-08-16 — — US disclosed
US-20140374706-A1 COMPOUND, ORGANIC OPTOELECTRIC DEVICE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE OPTOELECTRIC DEVICE CHEIL INDUSTRIES, INC. (KR) 2014-12-25 — — US disclosed
US-20140374706-A1 COMPOUND, ORGANIC OPTOELECTRIC DEVICE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE OPTOELECTRIC DEVICE CHEIL INDUSTRIES, INC. (KR) 2014-12-25 — — US disclosed
Send feedback