SCHEMBL1401388

SCHEMBL1401388

CC(C)CC(C)(C)C.CCC(C)C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
MMP8 P22894 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
SCHEMBL11485188 0.89 TSHR (0.33) TSHRTDP1
SCHEMBL2713018 0.89
SCHEMBL2686745 0.89
SCHEMBL30487170 0.89
SCHEMBL23992 0.89
Methane SCHEMBL11669299 0.86
Ammonia Solution, Strong SCHEMBL2909006 0.86
Iodide SCHEMBL31325854 0.86
Isobutane SCHEMBL3410753 0.86 TSHR (0.31) TSHRTDP1
Water SCHEMBL29494590 0.86

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
WO-2020017361-A1 HEAT-EXPANDABLE MICROSPHERE AND USE THEREOF 松本油脂製薬株式会社 2020-01-23 WO disclosed
EP-1303544-B1 METHOD OF REDUCING FORMATION OF PRECIPITATES IN SOLVENT RECOVERY SYSTEM UNION CARBIDE CHEM PLASTIC (US) 2011-03-02 EP disclosed