SCHEMBL15977645

SCHEMBL15977645

c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5cccc6nccnc56)ccc34)ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.40
MET P08581 1/20 0.39
HDAC4 P56524 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
GSK3B P49841 1/20 0.36
CDK5 Q00535 1/20 0.36
CDK5R1 Q15078 1/20 0.36
GSTP1 P09211 1/20 0.36
DHFR P00374 1/20 0.36
ACVR1 Q04771 3/20 0.36
ESR1 P03372 2/20 0.35
ESR2 Q92731 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
GPR84 Q9NQS5 1/20 0.34
HTR2B P41595 1/20 0.34
HTR5A P47898 1/20 0.34
PIM1 P11309 1/20 0.34
HSP90AA1 P07900 1/20 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
SCHEMBL15977660 0.95 ERN1 (0.36) ERN1METGSK3BCDK5CDK5R1
SCHEMBL18431873 0.87 ADORA2A (0.36) ERN1METACVR1ESR1ESR2
SCHEMBL10300889 0.87 TOP1 (0.40) ACVR1ESR1ESR2KDM4ETOP1
SCHEMBL24786275 0.83 ALDH1A1 (0.42) ERN1METHDAC4HDAC2HDAC8
SCHEMBL15977435 0.83 ACVR1 (0.50) ERN1METACVR1KDM4EHTR2B
SCHEMBL15977497 0.82 PIK3CA (0.45) ACVR1ESR1ESR2TOP1
SCHEMBL12577951 0.81 CCR1 (0.40) ERN1HDAC4HDAC2HDAC8GSTP1
SCHEMBL12578054 0.80 CCR1 (0.39) ERN1HDAC4HDAC2HDAC8GSTP1
SCHEMBL15977753 0.80 ADORA2A (0.40) METHDAC4HDAC2HDAC8ESR1
SCHEMBL62154 0.80 TOP1 (0.41) ERN1GSK3BCDK5CDK5R1ACVR1

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