SCHEMBL6009554

SCHEMBL6009554

C=C(C)C(=O)OC(CCC)C(O)CO

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TSHR P16473 3/20 0.36
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 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
SCHEMBL275196 0.90 TSHR (0.41) ALDH1A1TSHRLMNATHRBCYP2D6
SCHEMBL19898984 0.85 TSHR (0.39) ALDH1A1TSHRTHRB
SCHEMBL29754447 0.82 TSHR (0.33) ALDH1A1TSHR
SCHEMBL31384482 0.81 LMNA (0.32) LMNA
SCHEMBL13468872 0.81 TSHR (0.42) ALDH1A1TSHRTHRB
SCHEMBL501593 0.81 LMNA (0.40) ALDH1A1TSHRLMNATHRB
SCHEMBL4566106 0.81 TSHR (0.46) ALDH1A1TSHRTHRB
SCHEMBL28865022 0.80 ALDH1A1 (0.41) ALDH1A1TSHRTHRB
SCHEMBL22231348 0.80 TSHR (0.42) ALDH1A1TSHRTHRB
SCHEMBL9481348 0.80 ALDH1A1 (0.35) ALDH1A1TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060229423-A1 Process for the production of monodisperse and narrow disperse monofunctional silicones JOHNSON & JOHNSON VISION CARE, INC. 2006-10-12 US disclosed
US-5409731-A Method for imparting a hydrophilic nature to a contact lens TOMEI SANGYO KABUSHIKI KAISHA (JP) 1995-04-25 US disclosed
US-4235985-A ORGANOSILOXANE-CONTAINING POLYMETHACRYLATE TOYO CONTACT LENS CO., LTD. (JP) 1980-11-25 US disclosed