SCHEMBL4615936

SCHEMBL4615936

Cn1/c(=N/N)oc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 1/20 0.44
KCNQ2 O43526 1/20 0.44
ALDH1A1 P00352 4/20 0.36
NPSR1 Q6W5P4 2/20 0.36
GPR3 P46089 1/20 0.35
MAPK1 P28482 3/20 0.35
TSHR P16473 2/20 0.35
HPGD P15428 2/20 0.35
USP2 O75604 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GAA P10253 2/20 0.35
LMNA P02545 1/20 0.34
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 2/20 0.32
POLB P06746 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
SLC9A1 P19634 1/20 0.32
MIF P14174 1/20 0.32
ALKBH5 Q6P6C2 1/20 0.32

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
SCHEMBL4615937 1.00 KCNQ3 (0.44) KCNQ3KCNQ2ALDH1A1NPSR1GPR3
SCHEMBL2518002 0.84 KCNQ3 (0.49) KCNQ3KCNQ2ALDH1A1NPSR1GPR3
SCHEMBL2518009 0.84 KCNQ3 (0.49) KCNQ3KCNQ2ALDH1A1NPSR1GPR3
SCHEMBL2520354 0.84 KCNQ3 (0.49) KCNQ3KCNQ2ALDH1A1NPSR1GPR3
SCHEMBL2518006 0.84 KCNQ3 (0.49) KCNQ3KCNQ2ALDH1A1NPSR1GPR3
SCHEMBL5281384 0.75 KCNQ3 (0.46) KCNQ3KCNQ2ALDH1A1NPSR1GPR3
SCHEMBL5281385 0.75 KCNQ3 (0.46) KCNQ3KCNQ2ALDH1A1NPSR1GPR3
SCHEMBL4615120 0.74 ALDH1A1 (0.42) ALDH1A1NPSR1MAPK1TSHRHPGD
SCHEMBL5708494 0.73 KCNQ3 (0.50) KCNQ3KCNQ2ALDH1A1NPSR1GPR3
SCHEMBL170140 0.69 MAPK1 (0.57) ALDH1A1NPSR1MAPK1TSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1601335-B1 MEANS AND METHOD FOR THE SIMULTANEOUS BLEACHING AND DYEING OF KERATIN FIBRES WELLA AG (DE) 2008-03-19 EP claimed
EP-1599179-B1 AGENT AND METHOD FOR DYEING KERATIN FIBRES WELLA AG (DE) 2006-10-11 EP claimed
US-5518891-A SUBSTITUTED ANILINES, HYDRAZONES OR 4-AMINOANTIPYRINES ACTIMED LABORATORIES, INC. (US) 1996-05-21 US claimed
EP-1601335-B1 MEANS AND METHOD FOR THE SIMULTANEOUS BLEACHING AND DYEING OF KERATIN FIBRES WELLA AG (DE) 2008-03-19 EP disclosed
EP-1699427-B1 AGENT AND METHOD FOR OXIDATIVELY DYING KERATIN FIBERS WELLA AG (DE) 2008-02-27 EP disclosed
EP-1599179-B1 AGENT AND METHOD FOR DYEING KERATIN FIBRES WELLA AG (DE) 2006-10-11 EP disclosed
EP-1699426-A1 AGENT AND METHOD FOR OXIDATIVELY DYEING KERATIN FIBERS Wella Aktiengesellschaft (DE) 2006-09-13 EP disclosed
EP-1699427-A1 AGENT AND METHOD FOR OXIDATIVELY DYING KERATIN FIBERS Wella Aktiengesellschaft (DE) 2006-09-13 EP disclosed
EP-1601335-A1 MEANS AND METHOD FOR THE SIMULTANEOUS BLEACHING AND DYEING OF KERATIN FIBRES Wella Aktiengesellschaft (DE) 2005-12-07 EP disclosed
EP-1599179-A1 AGENT AND METHOD FOR DYEING KERATIN FIBRES Wella Aktiengesellschaft (DE) 2005-11-30 EP disclosed
WO-2005060927-A1 AGENT AND METHOD FOR OXIDATIVELY DYEING KERATIN FIBERS WELLA AKTIENGESELLSCHAFT (DE) 2005-07-07 WO disclosed
WO-2004078153-A1 AGENT AND METHOD FOR DYEING KERATIN FIBRES WELLA AKTIENGESELLSCHAFT (DE) 2004-09-16 WO disclosed
US-5518891-A SUBSTITUTED ANILINES, HYDRAZONES OR 4-AMINOANTIPYRINES ACTIMED LABORATORIES, INC. (US) 1996-05-21 US disclosed
EP-0025227-B1 PRECURSOR INDICATOR COMPOSITIONS MILES LABORATORIES, INC. (US) 1983-10-05 EP disclosed
US-4307188-A DIAGNOSIS AND DETECTION DEVICE MILES LABORATORIES, INC. (US) 1981-12-22 US disclosed
EP-0025227-A2 Precursor indicator compositions MILES LABORATORIES, INC. (US) 1981-03-18 EP disclosed
US-4247297-A A HYDRAZONE AND 8-AMINO-1-NAPTHOL-5,7-DISULFONIC ACID MILES LABORATORIES, INC. (US) 1981-01-27 US disclosed
US-4230798-A ANIMAL-ORIGINATED URICASE MILES LABORATORIES, INC. (US) 1980-10-28 US disclosed
US-4119405-A A HYDRAZONE AND 4,5-DIHYDROXY-2,7-NAPHTHALENEDISULFONIC ACID OR 1-HYDROXY-2-NAPHTHALENESULFONIC ACID MILES LABORATORIES, INC. (US) 1978-10-10 US disclosed
US-3979262-A COLORIMETRY HOFFMANN-LA ROCHE INC. (US) 1976-09-07 US disclosed