SCHEMBL11097569

SCHEMBL11097569

C=C(C)C(=O)OCCC(CCCCCC)C(N)(CC)CC

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.58
THRB P10828 2/20 0.41
FDPS P14324 1/20 0.39
ZDHHC7 Q9NXF8 1/20 0.36
FAAH O00519 1/20 0.35
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GPR84 Q9NQS5 3/20 0.33
NAAA Q02083 1/20 0.33
DGKA P23743 1/20 0.33
FFAR1 O14842 1/20 0.33
THRA P10827 1/20 0.32
RAD52 P43351 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CES2 O00748 1/20 0.32

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
SCHEMBL3694457 0.89 TSHR (0.58) TSHRTHRBFDPSZDHHC7FAAH
SCHEMBL22318914 0.89 TSHR (0.58) TSHRTHRBFDPSZDHHC7FAAH
Bromide SCHEMBL28903015 0.88 TSHR (0.56) TSHRTHRBFDPSZDHHC7FAAH
Hydrochloric Acid SCHEMBL10883860 0.88 TSHR (0.56) TSHRTHRBFDPSZDHHC7FAAH
Bromide SCHEMBL3698125 0.88 TSHR (0.56) TSHRTHRBFDPSZDHHC7FAAH
SCHEMBL1491880 0.87 TSHR (0.55) TSHRTHRBFDPSZDHHC7FAAH
SCHEMBL10883944 0.85 THRB (0.47) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11099183 0.81 TSHR (0.53) TSHRTHRBFDPSZDHHC7THRA
SCHEMBL28294714 0.80 TSHR (0.66) TSHRTHRBFDPSZDHHC7FAAH
SCHEMBL8776516 0.78 TSHR (0.67) TSHRTHRBFAAHGPR84FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4473813-A CROSSLINKED SILICONE RESIN HITACHI, LTD. (JP) 1984-09-25 US disclosed
EP-0076131-A1 Humidity sensor and method for preparing a humidity sensor Hitachi, Ltd. (JP) 1983-04-06 EP disclosed