SCHEMBL15977423

SCHEMBL15977423

c1cc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5ccccc5c4)c3c2)nc(-c2ncncn2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
CYP1A2 P05177 3/20 0.36
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
PKM P14618 1/20 0.36
TSHR P16473 1/20 0.36
KLF5 Q13887 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPK9 P45984 1/20 0.36
MAPK10 P53779 1/20 0.36
CTRC Q99895 1/20 0.35
CYP11B1 P15538 2/20 0.35
CYP11B2 P19099 2/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL15977454 0.95 KDM4E (0.36) KDM4ECYP1A2ALDH1A1SMN1; SMN2MAPT
SCHEMBL15977757 0.90 SMN1; SMN2 (0.43) KDM4ECYP1A2ALDH1A1SMN1; SMN2MAPT
SCHEMBL10300916 0.88 MEN1 (0.41) KDM4ECYP1A2ALDH1A1SMN1; SMN2MAPT
SCHEMBL15977437 0.88 CYP1A2 (0.45) KDM4ECYP1A2ALDH1A1SMN1; SMN2MAPT
SCHEMBL15977409 0.86 KDM4E (0.43) KDM4ECYP1A2ALDH1A1SMN1; SMN2MAPT
SCHEMBL15977878 0.85 SMN1; SMN2 (0.41) KDM4ECYP1A2ALDH1A1SMN1; SMN2MAPT
SCHEMBL15977787 0.84 KDM4E (0.41) KDM4ECYP1A2ALDH1A1SMN1; SMN2TP53
SCHEMBL15977637 0.84 CYP1A1 (0.43) KDM4ECYP1A2ALDH1A1SMN1; SMN2MAPT
SCHEMBL10300910 0.84 CYP1A1 (0.50) KDM4ECYP1A2ALDH1A1SMN1; SMN2MAPT
SCHEMBL15977653 0.84 CYP11B1 (0.41) KDM4ECYP1A2ALDH1A1SMN1; SMN2MAPT

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