SCHEMBL40071

SCHEMBL40071

Nc1ccc(CC2CCC(N)C(CC3CCC(N)CC3)C2)cc1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL14344293 1.00 HTR6 (0.33) HTR6MEN1KMT2A
SCHEMBL40077 0.81 MEN1 (0.44) HTR6MEN1KMT2A
Ammonia Solution, Strong SCHEMBL14343979 0.79 MEN1 (0.43) HTR6MEN1KMT2A
SCHEMBL8079322 0.77 MEN1 (0.36) HTR6MEN1KMT2A
SCHEMBL14407436 0.76 CYP3A4 (0.52) HTR6MEN1KMT2A
SCHEMBL39986 0.75
SCHEMBL7446113 0.73 MEN1 (0.49) HTR6MEN1KMT2A
SCHEMBL10025869 0.68
SCHEMBL342929 0.67 ALDH1A1 (0.40) HTR6
SCHEMBL7438487 0.66 NFE2L2 (0.47) HTR6MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8455673-B2 Water dispersible silanes NALCO COMPANY (US) 2013-06-04 US disclosed
US-8455673-B2 Water dispersible silanes NALCO COMPANY (US) 2013-06-04 US disclosed
US-8372999-B2 Organically modified silica and use thereof NALCO COMPANY (US) 2013-02-12 US disclosed
US-8372999-B2 Organically modified silica and use thereof NALCO COMPANY (US) 2013-02-12 US disclosed
US-20120125233-A1 ORGANICALLY MODIFIED SILICA AND USE THEREOF NALCO COMPANY 2012-05-24 US disclosed
US-20120125233-A1 ORGANICALLY MODIFIED SILICA AND USE THEREOF NALCO COMPANY 2012-05-24 US disclosed
US-8106229-B2 Organically modifid silica and use thereof NALCO COMPANY (US) 2012-01-31 US disclosed
US-8106229-B2 Organically modifid silica and use thereof NALCO COMPANY (US) 2012-01-31 US disclosed
US-20110067599-A1 WATER DISPERSIBLE SILANES AS CORROSION-PROTECTION COATINGS AND PAINT PRIMERS FOR METAL PRETREATMENT NALCO COMPANY 2011-03-24 US disclosed
US-20110067599-A1 WATER DISPERSIBLE SILANES AS CORROSION-PROTECTION COATINGS AND PAINT PRIMERS FOR METAL PRETREATMENT NALCO COMPANY 2011-03-24 US disclosed
US-7862862-B2 Water dispersible silanes as corrosion-protection coatings and paint primers for metal pretreatment NALCO COMPANY (US) 2011-01-04 US disclosed
US-7862862-B2 Water dispersible silanes as corrosion-protection coatings and paint primers for metal pretreatment NALCO COMPANY (US) 2011-01-04 US disclosed
US-20070282122-A1 Organically modifid silica and use thereof ECOLAB USA INC. 2007-12-06 US disclosed
US-20070282122-A1 Organically modifid silica and use thereof ECOLAB USA INC. 2007-12-06 US disclosed
WO-2007106214-A2 WATER DISPERSIBLE SILANES AS CORROSION-PROTECTION COATINGS AND PAINT PRIMERS FOR METAL PRETREATMENT NALCO COMPANY (US) 2007-09-20 WO disclosed
US-20070166467-A1 Water dispersible silanes as corrosion-protection coatings and paint primers for metal pretreatment ECOLAB USA INC. 2007-07-19 US disclosed
US-20070166467-A1 Water dispersible silanes as corrosion-protection coatings and paint primers for metal pretreatment ECOLAB USA INC. 2007-07-19 US 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-20070282122-A1 Organically modifid silica and use thereof SOST, SORD, POF1B HTR6 4327/4885MEN1 711/4885KMT2A 760/4885
US-20110067599-A1 WATER DISPERSIBLE SILANES AS CORROSION-PROTECTION COATINGS AND PAINT PRIMERS FOR METAL PRETREATMENT DNMT1, POLH, POLB HTR6 2625/4885MEN1 3300/4885KMT2A 224/4885

“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.