SCHEMBL9149367

SCHEMBL9149367

CCCCCC(C)(C)OOCCCC

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
SMPD1 P17405 1/20 0.31
TSHR P16473 2/20 0.30
THRB P10828 1/20 0.30
GGPS1 O95749 2/20 0.30
FDPS P14324 1/20 0.30
CYP3A4 P08684 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
SCHEMBL592345 0.91 ADRB2 (0.36) ADRB2ADRB1ADRB3TSHRCYP3A4
SCHEMBL9149359 0.84 THRB (0.35) TSHRTHRB
Hexane SCHEMBL28248364 0.84 THRB (0.35) TSHRTHRB
SCHEMBL11860369 0.84 TSHR (0.32) SMPD1TSHRTHRBGGPS1FDPS
SCHEMBL297925 0.83 TSHR (0.39) SMPD1TSHRTHRBGGPS1FDPS
SCHEMBL5512517 0.82 ADRB2 (0.33) ADRB2ADRB1ADRB3SMPD1TSHR
SCHEMBL28240527 0.82 TSHR (0.36) SMPD1TSHRTHRBGGPS1FDPS
SCHEMBL786803 0.81 TSHR (0.38) ADRB2ADRB1ADRB3TSHRCYP3A4
SCHEMBL7445172 0.80 TSHR (0.44) SMPD1TSHRTHRBGGPS1FDPS
SCHEMBL9625652 0.80 TSHR (0.37) SMPD1TSHRTHRBGGPS1FDPS

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-0635360-A1 Deep-drawable film, method for its manufacture and its use ALKOR GMBH KUNSTSTOFFE (DE) 1995-01-25 EP disclosed