SCHEMBL16216600

SCHEMBL16216600

c1ccc(-c2ccccc2N(c2ccc3ccc4c(N(c5ccccc5-c5ccccc5)c5cccc6c5oc5c(C7CCCC7)cccc56)ccc5ccc2c3c54)c2cccc3c2oc2c(C4CCCC4)cccc23)cc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
CASP3 P42574 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
CYP1B1 Q16678 1/20 0.31
PDK2 Q15119 1/20 0.30
PDK4 Q16654 1/20 0.30
PTGS2 P35354 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
SCHEMBL16216579 0.99 POLB (0.33) POLBCASP3SENP7SENP6CYP1B1
SCHEMBL17676457 0.94 POLB (0.31) POLBCASP3SENP7SENP6CYP1B1
SCHEMBL16216440 0.92 PDK2 (0.32) CYP1B1PDK2PDK4
SCHEMBL16216499 0.91 CYP1B1 (0.32) POLBCASP3SENP7SENP6CYP1B1
SCHEMBL18309911 0.91
SCHEMBL16216699 0.88 CYP1B1 (0.31) CYP1B1
SCHEMBL16216562 0.87 CYP1B1 (0.33) CYP1B1
SCHEMBL16216586 0.87 CYP1B1 (0.32) POLBCASP3SENP7SENP6CYP1B1
SCHEMBL21971935 0.87 CYP1B1 (0.34) POLBCASP3SENP7SENP6CYP1B1
SCHEMBL16216712 0.86 CYP1B1 (0.32) CYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9978948-B2 Ink composition, organic electroluminescence element, and electronic apparatus JOLED INC. (JP) 2018-05-22 US disclosed
US-9978948-B2 Ink composition, organic electroluminescence element, and electronic apparatus JOLED INC. (JP) 2018-05-22 US disclosed
US-20170148993-A1 INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC APPARATUS MAGNOLIA BLUE CORPORATION (JP) 2017-05-25 US disclosed
US-20170148993-A1 INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC APPARATUS MAGNOLIA BLUE CORPORATION (JP) 2017-05-25 US disclosed
US-9650519-B2 Ink composition, organic electroluminescence element, and electronic apparatus SONY CORPORATION (JP) 2017-05-16 US disclosed
US-9650519-B2 Ink composition, organic electroluminescence element, and electronic apparatus SONY CORPORATION (JP) 2017-05-16 US disclosed
US-20170073528-A1 INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC APPARATUS MAGNOLIA BLUE CORPORATION (JP) 2017-03-16 US disclosed
US-20170073528-A1 INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC APPARATUS MAGNOLIA BLUE CORPORATION (JP) 2017-03-16 US disclosed
US-9312500-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2016-04-12 US disclosed
US-9312500-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2016-04-12 US disclosed
US-20140326985-A1 AROMATIC AMINE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-11-06 US disclosed
US-20140326985-A1 AROMATIC AMINE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-11-06 US disclosed