SCHEMBL4444204

SCHEMBL4444204

CCCCC(OCCC)OCCC

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.38
SMPD1 P17405 3/20 0.35
ALDH1A1 P00352 3/20 0.33
CYP3A4 P08684 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
TSHR P16473 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
FDPS P14324 1/20 0.32
LMNA P02545 1/20 0.32
USP2 O75604 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL3381796 0.92 SMPD1 (0.43) DNM1SMPD1CA1CA2TSHR
SCHEMBL14778759 0.90 SMPD1 (0.47) DNM1SMPD1CA1CA2TSHR
SCHEMBL14779216 0.90 SMPD1 (0.47) DNM1SMPD1CA1CA2TSHR
SCHEMBL14779041 0.90 SMPD1 (0.47) DNM1SMPD1CA1CA2TSHR
SCHEMBL14778143 0.90 SMPD1 (0.47) DNM1SMPD1CA1CA2TSHR
SCHEMBL14779297 0.90 SMPD1 (0.47) DNM1SMPD1CA1CA2TSHR
SCHEMBL14778889 0.90 SMPD1 (0.47) DNM1SMPD1CA1CA2TSHR
SCHEMBL7531962 0.89 ADRB2 (0.39) DNM1SMPD1ALDH1A1CYP3A4TDP1
SCHEMBL12200029 0.87 DNM1 (0.33) DNM1SMPD1ALDH1A1CYP3A4TDP1
SCHEMBL31182103 0.87 ACE2 (0.41) DNM1SMPD1CA2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106103341-B Process for purifying phosphoric acid LXP集团有限公司 2019-07-02 CN claimed
EP-2094737-A1 CATALYST COMPONENT FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2009-09-02 EP claimed
WO-2008061662-A1 CATALYST COMPONENT FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2008-05-29 WO claimed
US-5354911-A From diacetals; catalyst composed of acid and amine HOECHST AKTIENGESELLSCHAFT (DE) 1994-10-11 US claimed
CN-113574041-B Bisphenol production method and polycarbonate resin production method 三菱化学株式会社 2023-10-13 CN disclosed
CN-113574041-A Method for producing bisphenol and method for producing polycarbonate resin 三菱化学株式会社 2021-10-29 CN disclosed
EP-2735581-B1 COMPOSITION AND POLYMER ASAHI CHEMICAL IND (JP) 2021-07-14 EP disclosed
WO-2020189201-A1 METHOD FOR PRODUCING BISPHENOL AND METHOD FOR PRODUCING POLYCARBONATE RESIN 三菱ケミカル株式会社 2020-09-24 WO disclosed
US-9738757-B2 Composition and polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2017-08-22 US disclosed
US-20160222168-A1 Composition and Polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-08-04 US disclosed
US-9334371-B2 Composition and polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-05-10 US disclosed
EP-2735581-A1 COMPOSITION AND POLYMER Asahi Kasei Chemicals Corporation (JP) 2014-05-28 EP disclosed
EP-0993431-A1 METHOD FOR PRODUCING ENOL ETHERS BASF AKTIENGESELLSCHAFT (DE) 2000-04-19 EP disclosed
EP-0703211-B1 Process for the preparation of unsaturated ethers DEGUSSA (DE) 1999-11-10 EP disclosed
WO-1998058894-A1 METHOD FOR PRODUCING ENOL ETHERS BASF AKTIENGESELLSCHAFT (DE) 1998-12-30 WO 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