SCHEMBL2123580

SCHEMBL2123580

CCCC(=O)c1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.73
ALDH1A1 P00352 7/20 0.73
KMT2A Q03164 5/20 0.73
HSD17B10 Q99714 5/20 0.73
CYP1A2 P05177 5/20 0.73
KDM4E B2RXH2 4/20 0.73
POLB P06746 3/20 0.73
CYP2D6 P10635 2/20 0.73
GLA P06280 1/20 0.73
LMNA P02545 3/20 0.48
MEN1 O00255 4/20 0.47
MAPT P10636 3/20 0.46
TSHR P16473 5/20 0.44
TDP1 Q9NUW8 4/20 0.44
CYP3A4 P08684 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
GMNN O75496 2/20 0.44
MAPK1 P28482 2/20 0.44
BLM P54132 2/20 0.44
PMP22 Q01453 2/20 0.44

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
SCHEMBL16516494 0.89 KMT2A (0.64) HPGDALDH1A1KMT2AHSD17B10CYP1A2
SCHEMBL1576755 0.89 KMT2A (0.64) HPGDALDH1A1KMT2AHSD17B10CYP1A2
SCHEMBL8584989 0.88 ALDH1A1 (0.66) HPGDALDH1A1KMT2AHSD17B10CYP1A2
SCHEMBL3297895 0.85 KMT2A (1.00) HPGDALDH1A1KMT2AHSD17B10CYP1A2
SCHEMBL3338282 0.85 ALDH1A1 (0.71) HPGDALDH1A1KMT2AHSD17B10CYP1A2
SCHEMBL27491740 0.84 ALDH1A1 (0.66) HPGDALDH1A1KMT2AHSD17B10CYP1A2
SCHEMBL4879006 0.84 ALDH1A1 (0.65) HPGDALDH1A1KMT2AHSD17B10CYP1A2
SCHEMBL28852424 0.83 KMT2A (0.85) HPGDALDH1A1KMT2AHSD17B10CYP1A2
Methylene Chloride SCHEMBL28345680 0.83 ALDH1A1 (0.60) HPGDALDH1A1KMT2AHSD17B10CYP1A2
SCHEMBL9359576 0.83 ALDH1A1 (0.74) HPGDALDH1A1KMT2AHSD17B10CYP1A2

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105636903-A Method for manufacturing ceramic-coated graphite WAPS CO LTD 2016-06-01 CN claimed
EP-0178743-B1 NOVEL TRITIUM LABELLED N-MUSTARD TYPE COMPOUNDS AND A PROCESS FOR THEIR PRODUCTION UNIVERSITY OF PITTSBURGH (US) 1990-05-23 EP claimed
US-4795627-A AZIRIDINIUM ANALOG USED TO EVALUATE THE MECHANISM OF NEUROTRANSMITTER REGULATION UNIVERSITY OF PITTSBURGH (US) 1989-01-03 US claimed
EP-0178743-A2 Novel tritium labelled N-mustard type compounds and a process for their production UNIVERSITY OF PITTSBURGH (US) 1986-04-23 EP claimed
US-11179471-B2 Peptide for cytosolic delivery KYOTO UNIVERSITY (JP) 2021-11-23 US disclosed
WO-2021020462-A1 INTRACELLULAR DELIVERY PEPTIDE 国立大学法人京都大学 2021-02-04 WO disclosed
US-20200046840-A1 PEPTIDE FOR CYTOSOLIC DELIVERY KYOTO UNIVERSITY (JP) 2020-02-13 US disclosed
EP-3604520-A1 PEPTIDE FOR CYTOSOLIC DELIVERY Kyoto University (JP) 2020-02-05 EP disclosed
CN-105636903-B Ceramic coating graphite manufacture method 伟普斯株式会社 2017-11-17 CN disclosed
CN-105636903-A Method for manufacturing ceramic-coated graphite WAPS CO LTD 2016-06-01 CN disclosed
CN-104508004-A Trigger-responsive chain fragmentation polymers UNIV ILLINOIS 2015-04-08 CN disclosed
WO-2014134509-A2 PEPTIDE-AND AMINE-MODIFIED GLUCAN PARTICLES FOR DELIVERY OF THERAPEUTIC CARGOES UNIVERSITY OF MASSACHUSETTS (US) 2014-09-04 WO disclosed
EP-0737201-A4 BACKBONE MODIFIED OLIGONUCLEOTIDE ANALOGS AND SOLID PHASE SYNTHESIS THEREOF ISIS PHARMACEUTICALS INC (US) 1998-12-30 EP disclosed
EP-0871670-A2 INHIBITORS OF MAdCAM-1-MEDIATED INTERACTIONS AND METHODS OF USE THEREFOR Leukosite, Inc. (US) 1998-10-21 EP disclosed
WO-1997025351-A2 INHIBITORS OF MAdCAM-1-MEDIATED INTERACTIONS AND METHODS OF USE THEREFOR LEUKOSITE, INC. (US) 1997-07-17 WO disclosed
EP-0737201-A1 BACKBONE MODIFIED OLIGONUCLEOTIDE ANALOGS AND SOLID PHASE SYNTHESIS THEREOF ISIS PHARMACEUTICALS, INC. (US) 1996-10-16 EP disclosed
WO-1995018136-A1 BACKBONE MODIFIED OLIGONUCLEOTIDE ANALOGS AND SOLID PHASE SYNTHESIS THEREOF ISIS PHARMACEUTICALS, INC. (US) 1995-07-06 WO disclosed
EP-0178743-B1 NOVEL TRITIUM LABELLED N-MUSTARD TYPE COMPOUNDS AND A PROCESS FOR THEIR PRODUCTION UNIVERSITY OF PITTSBURGH (US) 1990-05-23 EP disclosed
US-4795627-A AZIRIDINIUM ANALOG USED TO EVALUATE THE MECHANISM OF NEUROTRANSMITTER REGULATION UNIVERSITY OF PITTSBURGH (US) 1989-01-03 US disclosed
EP-0178743-A2 Novel tritium labelled N-mustard type compounds and a process for their production UNIVERSITY OF PITTSBURGH (US) 1986-04-23 EP disclosed