SCHEMBL7528798

SCHEMBL7528798

CCCCCOC(CCCCC)OCCCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.46
SMPD1 P17405 3/20 0.43
OPRM1 P35372 1/20 0.40
CA1 P00915 9/20 0.39
CA2 P00918 9/20 0.39
CA9 Q16790 8/20 0.39
CA12 O43570 3/20 0.38
CA7 P43166 3/20 0.38
CA14 Q9ULX7 3/20 0.38
CA3 P07451 2/20 0.38
CA4 P22748 2/20 0.38
CA6 P23280 2/20 0.38
CA5A P35218 2/20 0.38
CA5B Q9Y2D0 2/20 0.38
ALDH1A1 P00352 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
LMNA P02545 1/20 0.37
GLA P06280 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL15150906 0.97 DNM1 (0.50) DNM1SMPD1CA1CA2CA9
SCHEMBL16841233 0.97 DNM1 (0.50) DNM1SMPD1CA1CA2CA9
SCHEMBL19123980 0.97 DNM1 (0.50) DNM1SMPD1CA1CA2CA9
SCHEMBL873033 0.97 DNM1 (0.50) DNM1SMPD1CA1CA2CA9
SCHEMBL21828326 0.97 DNM1 (0.50) DNM1SMPD1CA1CA2CA9
SCHEMBL18180586 0.97 DNM1 (0.50) DNM1SMPD1CA1CA2CA9
SCHEMBL19123991 0.97 DNM1 (0.50) DNM1SMPD1CA1CA2CA9
SCHEMBL1897872 0.95 SMPD1 (0.43) DNM1SMPD1OPRM1CA1CA2
SCHEMBL7522319 0.95 DNM1 (0.46) DNM1SMPD1CA1CA2CA9
SCHEMBL14777882 0.92 SMPD1 (0.47) DNM1SMPD1OPRM1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5354911-A From diacetals; catalyst composed of acid and amine HOECHST AKTIENGESELLSCHAFT (DE) 1994-10-11 US claimed
EP-0993431-B1 METHOD FOR PRODUCING ENOL ETHERS BASF AG (DE) 2002-03-27 EP disclosed
US-6211416-B1 REACTING ACETAL OR KETAL WITH ACETYLENE OR ALLENE IN GAS PHASE IN PRESENCE OF CATALYST SELECTED FROM ZINC- OR CADMIUM-SILICON- AND OXYGEN-CONTAINING HETEROGENEOUS CATALYST BASF AKTIENGESELLSCHAFT (DE) 2001-04-03 US disclosed
EP-0703211-B1 Process for the preparation of unsaturated ethers DEGUSSA (DE) 1999-11-10 EP disclosed
US-5576465-A DEHYDROETHERIFICATION OF ACETALS OR KETALS BY HEATING HUELS AKTIENGESELLSCHAFT (DE) 1996-11-19 US disclosed
EP-0703211-A1 Process for the preparation of unsaturated ethers HÜLS AKTIENGESELLSCHAFT (DE) 1996-03-27 EP disclosed
EP-0490221-B1 Method for the production of unsaturated ethers HOECHST AG (DE) 1995-08-09 EP disclosed
US-5354911-A From diacetals; catalyst composed of acid and amine HOECHST AKTIENGESELLSCHAFT (DE) 1994-10-11 US disclosed
EP-0490221-A2 Method for the production of unsaturated ethers HOECHST AKTIENGESELLSCHAFT (DE) 1992-06-17 EP disclosed