SCHEMBL19915260

SCHEMBL19915260

CCN=C=NC(C)(C)C(C)(C)N

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 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
SCHEMBL531924 0.84
Hydrochloric Acid SCHEMBL28375754 0.81 CYP1A2 (0.34) CYP1A2CYP2D6
SCHEMBL8159853 0.78 CYP1A2 (0.30) CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL2289852 0.76
SCHEMBL266058 0.75 CYP1A2 (0.31) CYP1A2CYP2D6
SCHEMBL21815441 0.75 CYP1A2 (0.31) CYP1A2CYP2D6
SCHEMBL4429221 0.75
SCHEMBL34281 0.75
SCHEMBL6446030 0.73 CYP1A2 (0.30) CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL496495 0.73 CYP1A2 (0.30) 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-9907739-B2 Dermal injectable sterile composition TEOXANE (CH) 2018-03-06 US claimed