SCHEMBL16639331

SCHEMBL16639331

c1ccc(-c2ccccc2N(c2ccc(-c3ccc4ccc5c(-c6ccc(N(c7ccccc7-c7ccccc7)c7cccc8c7oc7ccccc78)cc6)ccc6ccc3c4c65)cc2)c2cccc3c2oc2ccccc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.38
CDC14B O60729 2/20 0.34
CDC14A Q9UNH5 2/20 0.34
CYP17A1 P05093 1/20 0.32
CYP19A1 P11511 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
PRKDC P78527 1/20 0.31
GGPS1 O95749 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 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
SCHEMBL16641956 0.95 ALOX5 (0.39) ALOX5CDC14BCDC14APRKDCGGPS1
SCHEMBL16639336 0.95 ALOX5 (0.34) ALOX5CDC14BCDC14A
SCHEMBL16639333 0.94 ALOX5 (0.36) ALOX5CDC14BCDC14APRKDCGGPS1
SCHEMBL16639610 0.94 ALOX5 (0.34) ALOX5CDC14BCDC14A
SCHEMBL22433797 0.92 ALOX5 (0.35) ALOX5CDC14BCDC14A
SCHEMBL16639311 0.92 ALOX5 (0.35) ALOX5CDC14BCDC14ACYP17A1CYP19A1
SCHEMBL16639337 0.91 ALOX5 (0.32) ALOX5
SCHEMBL21214774 0.88 ALOX5 (0.46) ALOX5CDC14BCDC14ACYP19A1PRKDC
SCHEMBL21206182 0.88 ALOX5 (0.43) ALOX5CDC14BCDC14ACYP17A1CYP19A1
SCHEMBL16639612 0.88 ALOX5 (0.33) ALOX5CDC14BCDC14A

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 6 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-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-20150102290-A1 DISUBSTITUTED PYRENE COMPOUNDS WITH AMINO GROUP CONTAINING ORTHO ARYL GROUP UNIVERSAL DISPLAY CORPORATION (US) 2015-04-16 US disclosed
US-20150102321-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-04-16 US disclosed
US-20150102290-A1 DISUBSTITUTED PYRENE COMPOUNDS WITH AMINO GROUP CONTAINING ORTHO ARYL GROUP UNIVERSAL DISPLAY CORPORATION (US) 2015-04-16 US disclosed
US-20150102321-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-04-16 US disclosed