SCHEMBL17036766

SCHEMBL17036766

C=C(C)C(=O)[N+](C)(C)CCC

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 1/20 0.34
TSHR P16473 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
ACHE P22303 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
Hydrochloric Acid SCHEMBL8682761 0.98 TSHR (0.35) BBOX1TSHRTDP1
SCHEMBL4602343 0.83 TSHR (0.44) TSHR
Bromide SCHEMBL27620439 0.81 DNM1 (0.45) TSHR
Hydrochloric Acid SCHEMBL28899726 0.81 TSHR (0.47) TSHR
Hydrochloric Acid SCHEMBL29163705 0.81 TSHR (0.47) TSHR
Hydrochloric Acid SCHEMBL28899670 0.81 TSHR (0.47) TSHR
Hydrochloric Acid SCHEMBL28899614 0.81 TSHR (0.47) TSHR
Hydrochloric Acid SCHEMBL28899621 0.81 TSHR (0.47) TSHR
SCHEMBL12522537 0.81 MEN1 (0.36) TDP1ACHE
SCHEMBL17846597 0.81 TDP1 (0.32) TDP1ACHE

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
US-9120305-B2 Image recording apparatus, image recording method, and storage medium CANON KABUSHIKI KAISHA (JP) 2015-09-01 US disclosed