SCHEMBL8834864

SCHEMBL8834864

C=CCCCCC(CCl)CC=C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
MAPT P10636 2/20 0.34
ABCC4 O15439 1/20 0.34
ALDH1A1 P00352 4/20 0.32
LMNA P02545 1/20 0.31
USP2 O75604 2/20 0.30
CYP3A4 P08684 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL8835377 0.84
SCHEMBL8834800 0.81 TSHR (0.38) TSHRMAPTABCC4ALDH1A1
SCHEMBL8834569 0.77 TSHR (0.35) TSHRALDH1A1
SCHEMBL14716699 0.76 TSHR (0.50) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL1710316 0.76 TSHR (0.43) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL7526836 0.76 TSHR (0.50) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL5440190 0.75
SCHEMBL3674102 0.75 TSHR (0.36) TSHRMAPTABCC4ALDH1A1
SCHEMBL30487039 0.73 TSHR (0.37) TSHRMAPTABCC4ALDH1A1USP2
SCHEMBL22791487 0.72 TSHR (0.46) TSHRALDH1A1

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-5686021-A Liquid crystal display device, methods of producing and driving the liquid crystal display device, and liquid crystal composition IDEMITSU KOSAN CO., LTD. (JP) 1997-11-11 US disclosed