SCHEMBL15030665

SCHEMBL15030665

Brc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1ccc(-c3ccccc3)cc1N2c1cccc(-c2ccccc2)c1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HSP90AA1 P07900 1/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.34
ATM Q13315 1/20 0.34
MGLL Q99685 1/20 0.34
AHR P35869 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
PGR P06401 2/20 0.31
HTR2A P28223 1/20 0.30
HTR2C P28335 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
SCHEMBL15030883 0.91 FAAH (0.37) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL15030671 0.90 FAAH (0.36) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL15030645 0.90 ALDH1A1 (0.39) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL15030655 0.88 EGLN1 (0.38) FAAHALDH1A1MGLLAHREGLN1
SCHEMBL15030759 0.87 ALDH1A1 (0.39) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL16186675 0.87 ALDH1A1 (0.39) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL15030757 0.87 ALDH1A1 (0.41) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL15030755 0.86 ALDH1A1 (0.38) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL16186705 0.85 ALDH1A1 (0.33) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL16186674 0.85 FAAH (0.36) FAAHALDH1A1HSP90AA1PKMHTT

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