SCHEMBL16645473

SCHEMBL16645473

c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccc6c(-c7ccc(N(c8ccc(-c9ccccc9)cc8)c8c(-c9ccccc9)cccc8-c8ccccc8)cc7)ccc7ccc4c5c76)cc3)c3ccccc3-c3ccccc3)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 2/20 0.32
CCND1 P24385 2/20 0.32
TNF P01375 1/20 0.31

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
SCHEMBL16641970 0.94 CRHR1 (0.33)
SCHEMBL16639634 0.93 RXRA (0.31) CDK4CCND1TNF
SCHEMBL16639338 0.93 RXRA (0.31) CDK4CCND1TNF
SCHEMBL16641952 0.93 RXRA (0.31) CDK4CCND1TNF
SCHEMBL16639340 0.92 CYP1A2 (0.35) CDK4CCND1TNF
SCHEMBL16639278 0.90 RXRA (0.31) CDK4CCND1TNF
SCHEMBL16639279 0.90 RXRA (0.31) CDK4CCND1TNF
SCHEMBL16641953 0.90 CA12 (0.34) CDK4CCND1TNF
SCHEMBL16641958 0.89 TNF (0.32) CDK4CCND1TNF
SCHEMBL16639330 0.88 RXRA (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9293712-B2 Disubstituted pyrene compounds with amino group containing ortho aryl group and devices containing the same UNIVERSAL DISPLAY CORPORATION (US) 2016-03-22 US disclosed
US-20150102321-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-04-16 US disclosed