SCHEMBL15977652

SCHEMBL15977652

c1ccc(-c2ncc(-c3ccc4c(-c5ccc6c(c5)C5(CCCCC5)c5ccccc5-6)c5ccccc5c(-c5ccc6c(c5)C5(CCCCC5)c5ccccc5-6)c4c3)cn2)cc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.35
NFKB1 P19838 2/20 0.35
RAB9A P51151 2/20 0.35
NFKB2 Q00653 2/20 0.35
RELA Q04206 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PGR P06401 3/20 0.34
PDK2 Q15119 4/20 0.33
HPGDS O60760 2/20 0.32
PDE7A Q13946 1/20 0.30
NPY5R Q15761 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
SCHEMBL15977769 0.99 NPC1 (0.36) NPC1NFKB1RAB9ANFKB2RELA
SCHEMBL15977683 0.96 NPC1 (0.35) NPC1NFKB1RAB9ANFKB2RELA
SCHEMBL15977623 0.95 NPC1 (0.36) NPC1NFKB1RAB9ANFKB2RELA
SCHEMBL10301151 0.88 HPGD (0.34) PGRPDK2
SCHEMBL15977493 0.87 PDK2 (0.34) PGRPDK2
SCHEMBL10301143 0.87 MEN1 (0.34) PGRPDK2
SCHEMBL10301081 0.86 HPGD (0.38) PGR
SCHEMBL10301154 0.86 PGR (0.36) PGRPDK2PDE7ANPY5R
SCHEMBL15977709 0.85 PDK2 (0.35) PGRPDK2NPY5R
SCHEMBL18431882 0.85 NPY5R (0.32) NPY5R

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