SCHEMBL381977

SCHEMBL381977

COC(=O)C(C)OOC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
CA14 Q9ULX7 3/20 0.37
CA12 O43570 2/20 0.37
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
DGAT1 O75907 1/20 0.32
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL13538204 0.76 SMN1; SMN2 (0.41) SMN1; SMN2CA14CA12CA1CA2
SCHEMBL10406576 0.76 ALDH1A1 (0.36) TSHRTDP1
SCHEMBL12057006 0.76 SMN1; SMN2 (0.41) SMN1; SMN2CA14CA12CA1CA2
SCHEMBL1828254 0.76 SMN1; SMN2 (0.41) SMN1; SMN2CA14CA12CA1CA2
SCHEMBL18070189 0.75
SCHEMBL18206341 0.70 CA14 (0.42) SMN1; SMN2CA14CA12CA1CA2
SCHEMBL18206340 0.70 CA14 (0.42) SMN1; SMN2CA14CA12CA1CA2
SCHEMBL4633092 0.69 SMN1; SMN2 (0.48) SMN1; SMN2CA14CA12CA1CA2
SCHEMBL2664131 0.69
SCHEMBL7580898 0.69 SMN1; SMN2 (0.48) SMN1; SMN2CA14CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3596148-B1 METHOD FOR PRODUCING POLYURETHANE BOOTS BASF SE (DE) 2021-05-19 EP disclosed
EP-2880069-B1 POLYUREA ELASTOMER HAVING INCREASED CHEMICAL RESISTANCE BASF SE (DE) 2019-03-27 EP disclosed
US-20180371138-A1 AQUEOUS SYNTHESIS AND IN-SITU RAPID SCREENING OF AMPHIPHILIC POLYMERS UNIVERSIDADE DE SANTIAGO DE COMPOSTELA (ES) 2018-12-27 US disclosed
WO-2018166870-A1 METHOD FOR PRODUCING POLYURETHANE BOOTS BASF SE (DE) 2018-09-20 WO disclosed
EP-2748233-B1 POLYETHER ALCOHOLS CONTAINING PARTICLES BASF SE (DE) 2018-07-25 EP disclosed
EP-2195363-B1 LOW-DENSITY POLYURETHANE FOAMS AND USE THEREOF IN SHOE SOLES BASF SE (DE) 2017-08-30 EP disclosed
EP-2445709-B1 Method for producing a foam compound element COVESTRO DEUTSCHLAND AG (DE) 2016-10-05 EP disclosed
EP-2209827-B1 FOAMED POLYURETHANES HAVING IMPROVED FLEXURAL ENDURANCE PROPERTIES BASF SE (DE) 2016-05-25 EP disclosed
EP-1692202-B1 THERMPLASTIC POLYURETHANE CONTAINING POLYMER POLYOLS BASF SE (DE) 2016-01-20 EP disclosed
EP-2748232-B1 POLYETHER ALCOHOLS CONTAINING PARTICLES BASF SE (DE) 2015-10-14 EP disclosed
EP-1487895-B1 GRAFT POLYOLS WITH A BIMODAL PARTICLE SIZE DISTRIBUTION AND METHOD FOR PRODUCING GRAFT POLYOLS OF THIS TYPE, IN ADDITION TO THE USE THEREOF FOR PRODUCING POLYURETHANES BASF AG (DE) 2006-08-02 EP disclosed
EP-1664147-A1 THERMOFORMED POLYURETHANE SOFT FOAM BASF AKTIENGESELLSCHAFT (DE) 2006-06-07 EP disclosed
WO-2005097863-A1 METHOD FOR THE PRODUCTION OF POLYURETHANE FOAM MATERIALS BASF AKTIENGESELLSCHAFT (DE) 2005-10-20 WO disclosed
EP-1554329-A1 METHOD FOR PRODUCING RIGID POLYURETHANE FOAMS BY MEANS OF GRAFT POLYHYDRIC ALCOHOLS BASF AKTIENGESELLSCHAFT (DE) 2005-07-20 EP disclosed
WO-2005054326-A1 THERMOPLASTIC POLYURETHANE CONTAINING POLYMER POLYOLS BASF AKTIENGESELLSCHAFT (DE) 2005-06-16 WO disclosed
WO-2005033169-A1 THERMOFORMED POLYURETHANE SOFT FOAM BASF AKTIENGESELLSCHAFT (DE) 2005-04-14 WO disclosed
EP-1487895-A1 GRAFT POLYOLS WITH A BIMODAL PARTICLE SIZE DISTRIBUTION AND METHOD FOR PRODUCING GRAFT POLYOLS OF THIS TYPE, IN ADDITION TO THE USE THEREOF FOR PRODUCING POLYURETHANES BASF AKTIENGESELLSCHAFT (DE) 2004-12-22 EP disclosed
WO-2004035650-A1 METHOD FOR PRODUCING RIGID POLYURETHANE FOAMS BY MEANS OF GRAFT POLYHYDRIC ALCOHOLS BASF AKTIENGESELLSCHAFT (DE) 2004-04-29 WO disclosed
WO-2003078496-A1 GRAFT POLYOLS WITH A BIMODAL PARTICLE SIZE DISTRIBUTION AND METHOD FOR PRODUCING GRAFT POLYOLS OF THIS TYPE, IN ADDITION TO THE USE THEREOF FOR PRODUCING POLYURETHANES BASF AKTIENGESELLSCHAFT (DE) 2003-09-25 WO disclosed
EP-0786480-A1 Polymer polyol and process for the preparation of polymer polyols SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1997-07-30 EP disclosed