SCHEMBL20394138

SCHEMBL20394138

CCC(C)CC(C)(C)C.CCC(C)CC(C)(C)C.CCC(C)CC(C)(C)C.CCC(C)CC(C)(C)C.OCC(CO)(CO)CO

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33

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
SCHEMBL20394145 0.91 TSHR (0.31) TSHR
SCHEMBL15503 0.84
Hypochlorous Acid SCHEMBL11417289 0.82 TSHR (0.33) TSHR
Ammonia Solution, Strong SCHEMBL4209045 0.82 TSHR (0.33) TSHR
Bicarbonate SCHEMBL9087678 0.78 CA2 (0.33) TSHR
SCHEMBL12225803 0.78 TSHR (0.35) TSHR
Ethylenediamine SCHEMBL6950671 0.75
SCHEMBL4234783 0.75 TSHR (0.32) TSHR
SCHEMBL1371443 0.74 TSHR (0.37) TSHR
SCHEMBL9225222 0.74 BHMT (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3351611-A1 REFRIGERATION MACHINE OIL, COMPOSITION FOR REFRIGERATION MACHINES, AND COMPRESSION-TYPE REFRIGERATION MACHINE Idemitsu Kosan Co., Ltd (JP) 2018-07-25 EP disclosed