SCHEMBL5835910

SCHEMBL5835910

CCC[C@H]1CC[C@H]([C@H]2CC[C@H](c3cc(F)ccc3C(=O)O)CC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.41
OPRL1 P41146 17/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.38

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
SCHEMBL5837468 1.00 CYP2C9 (0.41) CYP2C9OPRL1ALDH1A1LMNAMAPT
SCHEMBL5836884 0.90 PTGDR2 (0.40) OPRL1PTGDR2
SCHEMBL5837226 0.90 PTGDR2 (0.40) OPRL1PTGDR2
SCHEMBL9842453 0.84 TTR (0.48) OPRL1ALDH1A1LMNA
SCHEMBL15945922 0.84 CYP2C9 (0.42) CYP2C9OPRL1ALDH1A1LMNAMAPT
SCHEMBL16836614 0.82 KEAP1 (0.47) PTGDR2
SCHEMBL5682133 0.81 OPRL1 (0.45) OPRL1
SCHEMBL5682136 0.81 OPRL1 (0.45) OPRL1
SCHEMBL5682126 0.81 OPRL1 (0.45) OPRL1
SCHEMBL8387294 0.80 CYP2C9 (0.50) CYP2C9ALDH1A1LMNAMAPT

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
US-7045176-B2 Liquid crystal composition having high-speed response property and liquid crystal display using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2006-05-16 US disclosed
US-20040119051-A1 Liquid crystal composition having high-speed response property and liquid crystal display using the same SAMSUNG ELECTRONICS CO., LTD. 2004-06-24 US disclosed