SCHEMBL24625980

SCHEMBL24625980

CCNC(C)(C)C(C)CC

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL28393702 0.79 ALDH1A1 (0.31) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL1833054 0.77
SCHEMBL21445160 0.74
SCHEMBL21829185 0.74
SCHEMBL6006503 0.74 ALDH1A1 (0.33) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL24976350 0.74
SCHEMBL24860938 0.72
SCHEMBL21887775 0.72 ALDH1A1 (0.32) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL24522336 0.72
SCHEMBL29024610 0.72

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-20220220536-A1 COMPOSITIONS AND METHODS OF USING A DNA NANOSWITCH FOR THE DETECTION OF RNA THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK 2022-07-14 US disclosed