SCHEMBL9640979

SCHEMBL9640979

CCCN(CCO)c1ccc(C(=O)c2ccc(N(CCC)CCO)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.51
ERBB2 P04626 3/20 0.51
ALDH1A1 P00352 5/20 0.47
HPGD P15428 4/20 0.47
MAPT P10636 2/20 0.47
ESRRG P62508 2/20 0.47
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
HCAR3 P49019 2/20 0.41
CNR2 P34972 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
MCL1 Q07820 1/20 0.38
NOX1 Q9Y5S8 1/20 0.38
LMNA P02545 1/20 0.38
CRHR1 P34998 1/20 0.37

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
SCHEMBL10083911 0.94 HPGD (0.53) EGFRERBB2ALDH1A1HPGDESRRG
SCHEMBL2498524 0.93 EGFR (0.57) EGFRERBB2ALDH1A1HPGDMAPT
SCHEMBL11573012 0.91 ALDH1A1 (0.50) EGFRERBB2ALDH1A1HPGDMAPT
SCHEMBL9626015 0.87 MAPT (0.48) EGFRERBB2ALDH1A1HPGDMAPT
SCHEMBL24404041 0.86 ESRRG (0.61) EGFRERBB2ALDH1A1HPGDMAPT
SCHEMBL2742810 0.86 HPGD (0.59) EGFRERBB2ALDH1A1HPGDMAPT
SCHEMBL29138332 0.85 ESRRG (0.54) EGFRERBB2ALDH1A1HPGDMAPT
SCHEMBL23762214 0.84 EGFR (0.54) EGFRERBB2ALDH1A1HPGDMAPT
SCHEMBL4538369 0.84 HPGD (0.56) EGFRERBB2ALDH1A1HPGDMAPT
SCHEMBL27412476 0.84 ESRRG (0.52) EGFRERBB2ALDH1A1HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0331007-B1 LIGHT-SENSITIVE RECORDING MATERIALS FOR THE MANUFACTURE OF SCRATCH-RESISTANT INTAGLIO PRINTING FORMES BASF Aktiengesellschaft (DE) 1992-09-02 EP disclosed
US-4994348-A Light-sensitive recording materials for producing mar-resistant intaglio printing plates BASF AKTIENGESELLSCHAFT (DE) 1991-02-19 US disclosed
EP-0331007-A2 Light-sensitive recording materials for the manufacture of scratch-resistant intaglio printing formes BASF Aktiengesellschaft (DE) 1989-09-06 EP disclosed
US-4550072-A Photosensitive recording materials containing particles for the production of abrasion-resistant gravure printing plates, and the production of gravure printing plates using these recording materials BASF AKTIENGESELLSCHAFT (DE) 1985-10-29 US disclosed
US-4548894-A Photosensitive recording materials for the production of abrasion-resistant and scratch-resistant gravure printing plates comprising particles BASF AKTIENGESELLSCHAFT (DE) 1985-10-22 US disclosed
US-4147604-A PRINTING INKS, COATINGS, PRINTING PLATES BASF AKTIENGESELLSCHAFT (DE) 1979-04-03 US disclosed
EP-0000342-A1 Photopolymerisable binders BASF Aktiengesellschaft (DE) 1979-01-24 EP disclosed