SCHEMBL21440754

SCHEMBL21440754

SCC1CCCC1C1CCC1

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38

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
SCHEMBL10033578 0.84 ALDH1A1 (0.35) CYP1A2CYP2D6
SCHEMBL10533570 0.74 CYP1A2 (0.38) CYP1A2CYP2D6
SCHEMBL3536905 0.72 CYP1A2 (0.41) CYP1A2CYP2D6
SCHEMBL7735125 0.72 CYP1A2 (0.49) CYP1A2CYP2D6
SCHEMBL7734590 0.72 CYP1A2 (0.49) CYP1A2CYP2D6
SCHEMBL4277731 0.72 CYP1A2 (0.49) CYP1A2CYP2D6
SCHEMBL7880507 0.72 CYP1A2 (0.41) CYP1A2CYP2D6
SCHEMBL1287684 0.72 CYP1A2 (0.41) CYP1A2CYP2D6
SCHEMBL2379725 0.72 CYP1A2 (0.49) CYP1A2CYP2D6
SCHEMBL28038137 0.72 CYP1A2 (0.41) CYP1A2CYP2D6

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-10435722-B2 Carbon capture in fermentation LANZATECH NEW ZEALAND LIMITED (NZ) 2019-10-08 US disclosed