SCHEMBL1531522

SCHEMBL1531522

CCCC(=O)NNc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 1.00
CYP2C19 P33261 3/20 0.67
ALDH1A1 P00352 2/20 0.67
RECQL P46063 1/20 0.67
GAA P10253 8/20 0.61
MAPT P10636 2/20 0.61
KDM4E B2RXH2 1/20 0.61
GLA P06280 1/20 0.61
RAB9A P51151 1/20 0.61
HPGD P15428 1/20 0.59
CYP3A4 P08684 2/20 0.57
TSHR P16473 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.56
ALOX12 P18054 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.54
LMNA P02545 1/20 0.53
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50

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
Hydrochloric Acid SCHEMBL8957363 0.98 ALOX5 (0.96) ALOX5CYP2C19ALDH1A1RECQLGAA
SCHEMBL6633779 0.89 ALOX5 (0.80) ALOX5CYP2C19ALDH1A1RECQLGAA
SCHEMBL11133887 0.87 ALOX5 (0.77) ALOX5CYP2C19ALDH1A1RECQLGAA
SCHEMBL6635826 0.86 ALOX5 (0.75) ALOX5GAAHDAC3HDAC1HDAC2
SCHEMBL17548957 0.86 ALOX5 (0.75) ALOX5GAAHDAC3HDAC1HDAC2
SCHEMBL11337344 0.86 ALOX5 (0.75) ALOX5GAAHDAC3HDAC1HDAC2
SCHEMBL11418048 0.85 ALOX5 (0.73) ALOX5CYP2C19ALDH1A1RECQLGAA
SCHEMBL30513891 0.84 ALOX5 (0.72) ALOX5GAAKDM4ECYP3A4TSHR
SCHEMBL1531488 0.84 ALOX5 (0.72) ALOX5CYP2C19ALDH1A1GAAMAPT
SCHEMBL10968101 0.83 ALOX5 (0.71) ALOX5CYP2C19ALDH1A1RECQLGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104988207-B The α-hydroxybutyrate dehydrogenase reagent and detection method of a kind of stabilization, strong antijamming capability 山东博科生物产业有限公司 2019-09-03 CN disclosed
CN-104988207-A Stable alpha-hydroxybutyrate dehydrogenase reagent with high interference resistance capacity and detection method BIOBASE BIODUSTRY SHANDONG CO 2015-10-21 CN disclosed
EP-2485589-A1 HETEROARYL BTK INHIBITORS Biogen Idec MA Inc. (US) 2012-08-15 EP disclosed
WO-2011029043-A1 HETEROARYL BTK INHIBITORS BIOGEN IDEC MA INC. (US) 2011-03-10 WO disclosed
WO-2007107005-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE, INC. (CA) 2007-09-27 WO disclosed
US-6835522-B2 Multicolor; colorfastness; photostability FUJI PHOTO FILM CO., LTD. (JP) 2004-12-28 US disclosed
US-20020187417-A1 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. 2002-12-12 US disclosed
WO-1995002848-A1 MULTIFUNCTIONAL AZO COMPOUNDS AND POLYMERS DERIVED THEREFROM FOR NONLINEAR OPTICS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-01-26 WO disclosed
US-4018814-A ANTHELMINTICS BAYER AKTIENGESELLSCHAFT (DT) 1977-04-19 US disclosed
US-4013676-A NEMATOCIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-03-22 US disclosed
US-3996247-A ANTHELMINTIC BAYER AKTIENGESELLSCHAFT (DT) 1976-12-07 US disclosed
US-3971741-A DISPERSION PIGMENTS BAYER AKTIENGESELLSCHAFT (DT) 1976-07-27 US disclosed