SCHEMBL9178697

SCHEMBL9178697

CCCCOC(CCl)OCCCC

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
DNM1 Q05193 1/20 0.37
TSHR P16473 4/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 1/20 0.33
LMNA P02545 1/20 0.30
ATM Q13315 1/20 0.30
CA9 Q16790 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
SCHEMBL3677671 0.83 CA1 (0.31) CA1CA2
SCHEMBL8347145 0.78 ADRB2 (0.41) ADRB2ADRB1ADRB3DNM1TSHR
SCHEMBL2311733 0.78 ADRB2 (0.41) ADRB2ADRB1ADRB3DNM1TSHR
SCHEMBL16888431 0.77 THRB (0.35) LMNA
SCHEMBL9759984 0.76 ADRB2 (0.39) ADRB2ADRB1ADRB3DNM1TSHR
SCHEMBL7531962 0.76 ADRB2 (0.39) ADRB2ADRB1ADRB3DNM1TSHR
SCHEMBL351162 0.76 ADRB2 (0.39) ADRB2ADRB1ADRB3DNM1TSHR
SCHEMBL31636211 0.76 SMPD1 (0.40) ADRB2ADRB1ADRB3DNM1TSHR
SCHEMBL23038686 0.75 TSHR (0.48) ADRB2ADRB1ADRB3DNM1TSHR
SCHEMBL28851158 0.75 TSHR (0.48) ADRB2ADRB1ADRB3DNM1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4632111-A2 PROCESS FOR THE PREPARATION OF ACETALS OF ALPHA-CHLORO- OR ALPHA-BROMO-ALDEHYDES ESy-Labs-GmbH (DE) 2025-10-15 EP disclosed
EP-4632110-A1 PROCESS FOR THE HALOGENATION OF ORGANIC COMPOUNDS ESy-Labs-GmbH (DE) 2025-10-15 EP disclosed
US-5455361-A Process for preparing ketene acetals WACKER-CHEMIE GMBH (DE) 1995-10-03 US disclosed
EP-0589359-B1 Process for the production of ketene acetals WACKER CHEMIE GMBH (DE) 1995-06-28 EP disclosed
EP-0589359-A1 Process for the production of ketene acetals Wacker-Chemie GmbH (DE) 1994-03-30 EP disclosed
US-4163112-A INSECTICIDES VELSICOL CHEMICAL CORPORATION (US) 1979-07-31 US disclosed