SCHEMBL15977720

SCHEMBL15977720

c1ccc(-c2cc(-c3ccc(-c4ccc5c(-c6ccc7ccccc7c6)c6ccccc6c(-c6ccc7ccccc7c6)c5c4)cc3)nc(-c3ccccn3)n2)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.48
TSHR P16473 3/20 0.48
HSD17B10 Q99714 3/20 0.48
ALDH1A1 P00352 3/20 0.48
MAPT P10636 3/20 0.48
LMNA P02545 2/20 0.48
TP53 P04637 2/20 0.48
PKM P14618 2/20 0.48
KLF5 Q13887 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TDP1 Q9NUW8 1/20 0.41
CYP1A2 P05177 1/20 0.40
CCR1 P32246 1/20 0.39
CCR5 P51681 1/20 0.39
CCR8 P51685 1/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39
SIRT2 Q8IXJ6 2/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL15977461 0.95 KDM4E (0.50) KDM4ETSHRHSD17B10ALDH1A1MAPT
SCHEMBL15977734 0.93 KDM4E (0.47) KDM4ETSHRHSD17B10ALDH1A1MAPT
SCHEMBL24810523 0.91 TSHR (0.46) KDM4ETSHRHSD17B10ALDH1A1MAPT
SCHEMBL15977912 0.90 KDM4E (0.50) KDM4ETSHRHSD17B10ALDH1A1MAPT
SCHEMBL15977456 0.90 KDM4E (0.49) KDM4ETSHRHSD17B10ALDH1A1MAPT
SCHEMBL15977771 0.90 SMN1; SMN2 (0.48) KDM4ETSHRHSD17B10ALDH1A1MAPT
SCHEMBL24811953 0.89 KDM4E (0.48) KDM4ETSHRHSD17B10ALDH1A1MAPT
SCHEMBL15977713 0.89 TSHR (0.46) KDM4ETSHRHSD17B10ALDH1A1MAPT
SCHEMBL10353277 0.89 CCR1 (0.45) KDM4ETSHRHSD17B10ALDH1A1MAPT
SCHEMBL10353273 0.88 KDM4E (0.46) KDM4ETSHRHSD17B10ALDH1A1MAPT

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-9559311-B2 Anthracene derivative, organic-electroluminescence-device material, organic electroluminescence device, and electronic equipment IDEMITSU KOSAN CO., LTD. (JP) 2017-01-31 US disclosed
US-9559311-B2 Anthracene derivative, organic-electroluminescence-device material, organic electroluminescence device, and electronic equipment IDEMITSU KOSAN CO., LTD. (JP) 2017-01-31 US disclosed
US-20140239273-A1 ANTHRACENE DERIVATIVE, ORGANIC-ELECTROLUMINESCENCE-DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC EQUIPMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-08-28 US disclosed
US-20140239273-A1 ANTHRACENE DERIVATIVE, ORGANIC-ELECTROLUMINESCENCE-DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC EQUIPMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-08-28 US disclosed