SCHEMBL15030799

SCHEMBL15030799

O=P1(c2ccccc2)c2ccccc2C2(c3cc(Br)ccc3N(c3ccccc3)c3ccc(Br)cc32)c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.36
CNR1 P21554 1/20 0.32
EGLN1 Q9GZT9 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL15030788 0.85 ALDH1A1 (0.36) PGREGLN1
SCHEMBL15030802 0.79 PDK2 (0.36) PGR
SCHEMBL17470458 0.78 PDK2 (0.42) PGRCNR1EGLN1MEN1KMT2A
SCHEMBL15030713 0.77 PGR (0.38) PGRCNR1EGLN1MEN1KMT2A
SCHEMBL15030712 0.77 PGR (0.43) PGRCNR1EGLN1MEN1KMT2A
SCHEMBL15030714 0.77 PDK2 (0.41) PGRCNR1EGLN1MEN1KMT2A
SCHEMBL16186690 0.76 ADAMTS5 (0.32)
SCHEMBL20588385 0.76 PDK2 (0.40) PGRCNR1EGLN1MEN1KMT2A
SCHEMBL15030785 0.76 PGR (0.40) PGRCNR1EGLN1MEN1KMT2A
SCHEMBL15030657 0.75 AHR (0.41) PGRCNR1EGLN1MEN1KMT2A

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
EP-2780325-B1 SPIRO-DIHYDROACRIDINE DERIVATIVES AND THEIR USE AS MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2016-02-03 EP disclosed
US-20140316134-A1 SPIRO DIHYDROACRIDINE DERIVATIVES AND THE USE THEREOF AS MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2014-10-23 US disclosed
US-20140316134-A1 SPIRO DIHYDROACRIDINE DERIVATIVES AND THE USE THEREOF AS MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2014-10-23 US disclosed
WO-2013083216-A1 SPIRO DIHYDROACRIDINE DERIVATIVES AND THE USE THEREOF AS MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2013-06-13 WO disclosed