SCHEMBL7713475

SCHEMBL7713475

CCCNNCCNNCCC

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.37
ADH1A P07327 1/20 0.37
ADH7 P40394 1/20 0.37
CA1 P00915 1/20 0.37
TSHR P16473 2/20 0.33
ALDH1A1 P00352 1/20 0.33
EPHX1 P07099 1/20 0.30
DNM1 Q05193 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30

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
SCHEMBL308930 0.95
Hydrochloric Acid SCHEMBL740345 0.91
SCHEMBL20050177 0.86
SCHEMBL239272 0.84
SCHEMBL309582 0.81
SCHEMBL175143 0.78
SCHEMBL11320949 0.78 TSHR (0.56) ADH1BADH1AADH7TSHRALDH1A1
SCHEMBL14220275 0.78
SCHEMBL237213 0.78
SCHEMBL18220749 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6365100-B1 CORROSION RESISTANCE OF STEEL IN AQUEOUS SOLUTION CECA, S.A. (FR) 2002-04-02 US disclosed
EP-0958404-A1 POLYMETHYLENEPOLYAMINE DIPROPIONAMIDES AS ENVIRONMENTALLY SAFE INHIBITORS OF THE CARBON CORROSION OF IRON CECA S.A. (FR) 1999-11-24 EP disclosed
WO-1998035072-A1 POLYMETHYLENEPOLYAMINE DIPROPIONAMIDES AS ENVIRONMENTALLY SAFE INHIBITORS OF THE CARBON CORROSION OF IRON CECA S.A. (FR) 1998-08-13 WO disclosed