SCHEMBL9687270

SCHEMBL9687270

CCCCOC(C)C(=O)Cl

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
DNM1 Q05193 1/20 0.41
TP53 P04637 2/20 0.39
ATM Q13315 1/20 0.39
TSHR P16473 4/20 0.37
HPGD P15428 1/20 0.36
LMNA P02545 3/20 0.35
ESR1 P03372 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP2C19 P33261 1/20 0.35
NR1H2 P55055 1/20 0.35
RNASEL Q05823 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HCAR2 Q8TDS4 1/20 0.34

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
SCHEMBL9688942 0.94 DNM1 (0.48) ALDH1A1DNM1TP53TSHRLMNA
SCHEMBL9688338 0.92 DNM1 (0.52) ALDH1A1DNM1TP53TSHRLMNA
SCHEMBL5162959 0.92 DNM1 (0.52) ALDH1A1DNM1TP53TSHRLMNA
SCHEMBL9345472 0.92 DNM1 (0.52) ALDH1A1DNM1TP53TSHRLMNA
SCHEMBL9405709 0.92 DNM1 (0.52) ALDH1A1DNM1TP53TSHRLMNA
SCHEMBL9687227 0.92 DNM1 (0.52) ALDH1A1DNM1TP53TSHRLMNA
SCHEMBL9405821 0.92 DNM1 (0.52) ALDH1A1DNM1TP53TSHRLMNA
SCHEMBL9345466 0.92 DNM1 (0.52) ALDH1A1DNM1TP53TSHRLMNA
SCHEMBL9340831 0.86
SCHEMBL9340828 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5167857-A Optically active, optical modulation CANON KABUSHIKI KAISHA (JP) 1992-12-01 US disclosed
EP-0175591-B1 LACTIC ACID DERIVATIVE, LIQUID CRYSTAL COMPOSITION CONTAINING SAME AND LIQUID CRYSTAL DEVICE CANON KABUSHIKI KAISHA (JP) 1991-03-06 EP disclosed
US-4775223-A DISPLAY DEVICE CANON KABUSHIKI KAISHA (JP) 1988-10-04 US disclosed
EP-0175591-A2 Lactic acid derivative, liquid crystal composition containing same and liquid crystal device CANON KABUSHIKI KAISHA (JP) 1986-03-26 EP disclosed