SCHEMBL4298620

SCHEMBL4298620

Sc1ccccc1C1=NCCCN1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 10/20 0.58
GAA P10253 1/20 0.58
TSHR P16473 1/20 0.58
TOP2A P11388 4/20 0.47
TOP2B Q02880 4/20 0.47

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
SCHEMBL4066263 0.89 NISCH (0.62) NISCH
SCHEMBL6745405 0.83 NISCH (0.51) NISCHGAATSHRTOP2ATOP2B
SCHEMBL6745419 0.80 NISCH (0.48) NISCHGAATSHR
SCHEMBL5307832 0.79 TOP2A (0.61) NISCHGAATSHRTOP2ATOP2B
SCHEMBL5441899 0.79 NISCH (0.59) NISCHGAATSHRTOP2ATOP2B
SCHEMBL13830922 0.79 NISCH (0.58) NISCHGAATSHRTOP2ATOP2B
SCHEMBL14046102 0.79 NISCH (0.58) NISCHGAATSHRTOP2ATOP2B
SCHEMBL6746742 0.79 NISCH (0.80) NISCHGAATSHRTOP2ATOP2B
SCHEMBL4822597 0.79 NISCH (0.80) NISCHGAATSHRTOP2ATOP2B
SCHEMBL11273702 0.79 NISCH (0.58) NISCHGAATSHRTOP2ATOP2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2933265-B1 Pharmacological chaperones for treating obesity AMICUS THERAPEUTICS INC (US) 2018-11-14 EP disclosed
EP-1885366-B1 PHARMACOLOGICAL CHAPERONES FOR TREATING OBESITY AMICUS THERAPEUTICS INC (US) 2018-05-30 EP disclosed
US-9381194-B2 Pharmacological chaperones for treating obesity AMICUS THERAPEUTICS, INC. (US) 2016-07-05 US disclosed
WO-2016056606-A1 BENZOISOTHIAZOLOPYRIMIDINE DERIVATIVE AND SALT THEREOF,AND VIRAL INFECTION INHIBITOR AND DRUG 国立大学法人京都大学 2016-04-14 WO disclosed
EP-2933265-A2 Pharmacological chaperones for treating obesity Amicus Therapeutics, Inc. (US) 2015-10-21 EP disclosed
US-20090312345-A1 PHARMACOLOGICAL CHAPERONES FOR TREATING OBESITY AMICUS THERAPEUTICS, INC. (US) 2009-12-17 US disclosed
US-20080269217-A1 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-10-30 US disclosed
US-20080269217-A1 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-10-30 US disclosed
US-20080269217-A1 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-10-30 US disclosed
US-7375125-B2 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-05-20 US disclosed
WO-2005121100-A1 MELANOCORTIN-4 RECEPTOR BINDING COMPOUNDS AND METHODS OF USE THEREOF GENE LOGIC INC. (US) 2005-12-22 WO disclosed
US-20040082779-A1 Melanocortin-4 receptor binding compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. 2004-04-29 US disclosed
US-6699873-B1 EATING DISORDERS MILLENNIUM PHARMACEUTICALS, INC. 2004-03-02 US disclosed
EP-1363890-A2 MELANOCORTIN-4 RECEPTOR BINDING COMPOUNDS AND METHODS OF USE THEREOF Millennium Pharmaceuticals, Inc. (US) 2003-11-26 EP disclosed
WO-2002062766-A2 MELANOCORTIN-4 RECEPTOR BINDING COMPOUNDS AND METHODS OF USE THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2002-08-15 WO disclosed
EP-1204645-A2 MELANOCORTIN-4 RECEPTOR BINDING COMPOUNDS AND METHODS OF USE THEREOF Millennium Pharmaceuticals, Inc. (US) 2002-05-15 EP disclosed
WO-2001010842-A2 MELANOCORTIN-4 RECEPTOR BINDING COMPOUNDS AND METHODS OF USE THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2001-02-15 WO disclosed
EP-0799831-B1 IR absorbing phthalocyanines BASF AG (DE) 2000-05-24 EP disclosed
US-5783694-A IR-absorbing phthalocyanines BASF AKTIENGESELLSCHAFT (DE) 1998-07-21 US disclosed
EP-0799831-A1 IR absorbing phthalocyanines BASF AKTIENGESELLSCHAFT (DE) 1997-10-08 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080269217-A1 Melanocortin-4 receptor binding compounds and methods of use thereof MC4R, MC5R, MC3R NISCH 1934/4885GAA 2982/4885TSHR 47/4885
US-20040082779-A1 Melanocortin-4 receptor binding compounds and methods of use thereof MC4R, MC5R, MC1R NISCH 2500/4885GAA 2702/4885TSHR 56/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.