SCHEMBL11510952

SCHEMBL11510952

CCCCCCC=NC1CC(C)(C)N(C)C(C)(C)C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 5/20 0.33
GNAO1 P09471 5/20 0.33
GNAI1 P63096 5/20 0.33
GBA1 P04062 1/20 0.31
TSHR P16473 2/20 0.31

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
SCHEMBL11510950 1.00 GNAI3 (0.33) GNAI3GNAO1GNAI1GBA1TSHR
SCHEMBL27906509 0.77 MAPK1 (0.34) TSHR
SCHEMBL10774842 0.76 GAA (0.35)
SCHEMBL2731387 0.74 TSHR (0.37) TSHR
SCHEMBL2731386 0.74 TSHR (0.37) TSHR
SCHEMBL8613131 0.74
SCHEMBL17336101 0.72 CYP1A2 (0.39) TSHR
SCHEMBL17336058 0.72 CYP1A2 (0.39) TSHR
SCHEMBL17921777 0.72 CYP1A2 (0.39) TSHR
SCHEMBL17336102 0.72 CYP1A2 (0.39) TSHR

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-4144224-A FOR POLYOLEFINS, POLYAMIDES, AND POLYURETHANES CIBA-GEIGY CORPORATION (US) 1979-03-13 US disclosed