SCHEMBL31365244

SCHEMBL31365244

C=C(C(=O)OCCO)C1CC(C)CC(C)(C)C1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.33
LMNA P02545 2/20 0.33
NR1I2 O75469 1/20 0.33
ABCB11 O95342 1/20 0.33
ALDH1A1 P00352 3/20 0.32
CYP2C19 P33261 3/20 0.32
CYP3A4 P08684 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
HTT P42858 1/20 0.30
CYP2D6 P10635 2/20 0.30
CYP2B6 P20813 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL28045313 0.80 APLNR (0.38) APLNRLMNANR1I2ABCB11ALDH1A1
SCHEMBL532643 0.75 APLNR (0.47) APLNRLMNANR1I2ABCB11ALDH1A1
SCHEMBL1412371 0.73 APLNR (0.41) APLNRLMNANR1I2ABCB11ALDH1A1
SCHEMBL14914802 0.72 TSHR (0.39)
SCHEMBL31365245 0.72 ALDH1A1 (0.34) LMNANR1I2ABCB11ALDH1A1CYP2C19
SCHEMBL14547349 0.71 LMNA (0.48) LMNANR1I2ABCB11ALDH1A1CYP2C19
SCHEMBL225096 0.69 APLNR (0.46) APLNRLMNANR1I2ABCB11ALDH1A1
SCHEMBL5883941 0.67 APLNR (0.67) APLNRLMNANR1I2ABCB11ALDH1A1
SCHEMBL3778963 0.67 APLNR (0.48) APLNRLMNANR1I2ABCB11ALDH1A1
SCHEMBL3129361 0.66 APLNR (0.46) APLNRLMNANR1I2ABCB11ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4748210-A1 SOLAR CELL COMPRISING A POLYMER LAYER COMPRISING ACRYLATES Avantama AG (CH) 2026-05-27 EP disclosed
WO-2025021278-A1 SOLAR CELL COMPRISING A POLYMER LAYER COMPRISING ACRYLATES AVANTAMA AG (CH) 2025-01-30 WO disclosed