SCHEMBL15853005

SCHEMBL15853005

CC(C)(C)N(c1ccccc1F)c1ccc(-c2cccc(-c3ccccc3)c2)c(-c2ccccc2)c1F

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.33
TACR1 P25103 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
SCHEMBL15853011 0.95 ACLY (0.33) ACLYTACR1
SCHEMBL15853017 0.91 PTGS2 (0.33) ACLYTACR1
SCHEMBL15853022 0.91 PTGS2 (0.33) ACLYTACR1
SCHEMBL15853045 0.91 AKR1C3 (0.36) ACLY
SCHEMBL15852990 0.91 TACR1 (0.33) TACR1
SCHEMBL15853031 0.89 AKR1C3 (0.34) ACLY
SCHEMBL15853079 0.87 AKR1C3 (0.34) ACLY
SCHEMBL15853062 0.87 AKR1C3 (0.34) ACLY
SCHEMBL15853001 0.87 TACR1 (0.34) ACLYTACR1
SCHEMBL15853046 0.86 AKR1C3 (0.36) ACLY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9905776-B2 Pyrene-based compound and organic light-emitting diode comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-02-27 US disclosed
US-9905776-B2 Pyrene-based compound and organic light-emitting diode comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-02-27 US disclosed
US-20140183468-A1 PYRENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-03 US disclosed