SCHEMBL24823151

SCHEMBL24823151

CCOCOc1c(C)cccc1C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
GAA P10253 1/20 0.43
GABRA1 P14867 1/20 0.42
GABRB2 P47870 1/20 0.42
NLRP3 Q96P20 1/20 0.42
SCN2A Q99250 3/20 0.38
SCN4A P35499 6/20 0.35
LMNA P02545 2/20 0.35
SCN1A P35498 2/20 0.35
SCN5A Q14524 2/20 0.35
SCN9A Q15858 2/20 0.35
CYP2D6 P10635 2/20 0.35
SCN8A Q9UQD0 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
TSHR P16473 1/20 0.35
NFKB1 P19838 1/20 0.35

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
SCHEMBL23906780 0.84 SCN4A (0.47) ALDH1A1KDM4ESCN2ASCN4ALMNA
SCHEMBL6832124 0.83 ALDH1A1 (0.54) ALDH1A1KDM4ESMN1; SMN2GAAGABRA1
SCHEMBL16479215 0.79 ALDH1A1 (0.61) ALDH1A1KDM4ESMN1; SMN2GAAGABRA1
SCHEMBL73389 0.76 ALDH1A1 (0.61) ALDH1A1KDM4ESMN1; SMN2GAAGABRA1
SCHEMBL9186079 0.76 ALDH1A1 (0.54) ALDH1A1KDM4ESMN1; SMN2GAAGABRA1
SCHEMBL11333666 0.75 ALDH1A1 (0.60) ALDH1A1KDM4ESMN1; SMN2GAAGABRA1
SCHEMBL11772725 0.74 GABRA1 (0.54) ALDH1A1KDM4ESMN1; SMN2GAAGABRA1
SCHEMBL23906793 0.74 PIM1 (0.39) KDM4ESCN8AKCNK3MAOA
SCHEMBL6090926 0.73 ALDH1A1 (0.51) ALDH1A1KDM4ESMN1; SMN2GAAGABRA1
SCHEMBL15283253 0.73 SCN4A (0.39) ALDH1A1KDM4ESCN2ASCN4ALMNA

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
WO-2022271338-A1 AMINE-SUBSTITUTED 2-AMINO-ETHAN-1-OLYL POLYMERS, POLYIMIDES, ARTICLES, AND METHODS ESSEX FURUKAWA MAGNET WIRE USA LLC (US) 2022-12-29 WO disclosed