SCHEMBL556828

SCHEMBL556828

CCC(C)N(CCCO)C(C)CC

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 2/20 0.32
TSHR P16473 2/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL813088 0.84 MAPT (0.36) ALDH1A1TSHR
SCHEMBL9641367 0.82 CYP1A2 (0.31) HSD17B10
SCHEMBL7770556 0.79 DNM1 (0.32) ALDH1A1LMNATSHR
SCHEMBL6141867 0.78 TDP1 (0.37) ALDH1A1TSHRMEN1KMT2A
SCHEMBL9950582 0.78 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2LMNATSHRHSD17B10
SCHEMBL23736371 0.76 ALDH1A1 (0.32) ALDH1A1SMN1; SMN2
SCHEMBL9641347 0.76 CYP1A2 (0.32) SMN1; SMN2HSD17B10
SCHEMBL9949397 0.76 ALDH1A1 (0.32) ALDH1A1SMN1; SMN2
SCHEMBL557434 0.76 MEN1 (0.46) ALDH1A1SMN1; SMN2LMNATSHRHSD17B10
SCHEMBL9807757 0.75 DNM1 (0.46) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4549621-A1 PROCESS FOR MAKING AMINES FROM ALCOHOLS USING HYDROGEN HAVING LOW DEUTERIUM CONTENT PRODUCED WITH NON-FOSSIL ENERGY BASF SE (DE) 2025-05-07 EP disclosed
EP-2506966-B1 CATALYST AND METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2017-08-16 EP disclosed
EP-2506965-B1 CATALYST AND METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2016-11-09 EP disclosed
EP-2225029-B1 METHOD AND CATALYST FOR PRODUCING AN AMINE BASF SE (DE) 2016-08-03 EP disclosed
US-9174201-B2 Method for the continuous production of an amine using an aluminum—copper catalyst BASF SE (DE) 2015-11-03 US disclosed
EP-2883862-A1 Method for manufacturing amines BASF SE (DE) 2015-06-17 EP disclosed
US-8765634-B2 Processes for preparing amines and zirconium dioxide- and nickel-containing catalysts for use therein BASF SE (DE) 2014-07-01 US disclosed
EP-2346602-B1 METHOD FOR THE CONTINUOUS PRODUCTION OF AN AMINE USING AN ALUMINIUM-COPPER CATALYST BASF SE (DE) 2014-03-19 EP disclosed
US-20130310560-A1 PROCESSES FOR PREPARING AMINES AND CATALYSTS FOR USE THEREIN BASF SE (DE) 2013-11-21 US disclosed
US-8487135-B2 Catalyst and process for preparing an amine BASF SE (DE) 2013-07-16 US disclosed
WO-2005110969-A1 METHOD FOR THE CONTINUOUS PRODUCTION OF AN AMINE BASF AKTIENGESELLSCHAFT (DE) 2005-11-24 WO disclosed
US-20050107637-A1 Catalysts and method for the production of amines BASF AKTIENGESELLSCHAFT (DE) 2005-05-19 US disclosed
US-20040122259-A1 Preparation of an amine BASF AKTIENGESELLSCHAFT (DE) 2004-06-24 US disclosed
EP-1431271-A1 Process for the preparation of an amine BASF AKTIENGESELLSCHAFT (DE) 2004-06-23 EP disclosed
US-6187957-B1 CATALYTIC AMINATION OF ALCOHOLS, ALDEHYDES OR KETONES IN THE PRESENCE OF HYDROGEN; THE AMINES ARE USED AS BLOWING AGENTS FOR POLYURETHANE PRODUCTION, CATALYSTS FOR THE PREPARATION OF SURFACTANTS AND POLYMERS, INTERMEDIATES FOR DYES BASF AKTIENGESELLSCHAFT (DE) 2001-02-13 US disclosed
US-6057442-A Preparation of amines BASF AKTIENGESELLSCHAFT (DE) 2000-05-02 US disclosed
EP-0963975-A1 Amines preparation process BASF AKTIENGESELLSCHAFT (DE) 1999-12-15 EP disclosed
EP-0905122-A2 Process for the preparation of amines BASF AKTIENGESELLSCHAFT (DE) 1999-03-31 EP disclosed
US-5608113-A Process for preparation of diamines by catalytic amination of aminoalcohols BASF AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed
EP-0697395-A2 Process for the preparation of diamines by catalytic amination of amino alcohols BASF AKTIENGESELLSCHAFT (DE) 1996-02-21 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 (3 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-20130310560-A1 PROCESSES FOR PREPARING AMINES AND CATALYSTS FOR USE THEREIN AOC3, SCO2, SOD1 ALDH1A1 1265/4885SMN1; SMN2 2824/4885LMNA 3986/4885
US-20040122259-A1 Preparation of an amine ADH1A, PNMT, ADH1C ALDH1A1 244/4885SMN1; SMN2 2722/4885LMNA 1869/4885
US-20050107637-A1 Catalysts and method for the production of amines AOC2, AOC3, AOC1 ALDH1A1 621/4885SMN1; SMN2 1587/4885LMNA 3866/4885

“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.