SCHEMBL9688501

SCHEMBL9688501

CCCCC(C=O)=COCC

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 3/20 0.38
TP53 P04637 1/20 0.38
CES1 P23141 3/20 0.36
CES2 O00748 2/20 0.36
CA1 P00915 1/20 0.32
TSHR P16473 2/20 0.31
TRPA1 O75762 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
SCHEMBL7847435 0.94 LMNA (0.46) LMNATDP1ALDH1A1CES1CES2
SCHEMBL9514188 0.94 LMNA (0.46) LMNATDP1ALDH1A1CES1CES2
SCHEMBL7847438 0.94 LMNA (0.46) LMNATDP1ALDH1A1CES1CES2
SCHEMBL11613413 0.92 TDP1 (0.47) LMNATDP1ALDH1A1CES1CES2
SCHEMBL11613415 0.92 TDP1 (0.47) LMNATDP1ALDH1A1CES1CES2
SCHEMBL7091533 0.92 TDP1 (0.47) LMNATDP1ALDH1A1CES1CES2
SCHEMBL9562087 0.92 TDP1 (0.47) LMNATDP1ALDH1A1CES1CES2
SCHEMBL11069975 0.92 TDP1 (0.47) LMNATDP1ALDH1A1CES1CES2
SCHEMBL7091531 0.92 TDP1 (0.47) LMNATDP1ALDH1A1CES1CES2
SCHEMBL9562083 0.92 TDP1 (0.47) LMNATDP1ALDH1A1CES1CES2

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