SCHEMBL4871184

SCHEMBL4871184

CC(C(=O)O)=C(CC(=O)O)CC1CO1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 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
SCHEMBL498679 0.88 ALDH1A1 (0.37) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL9868371 0.86 ALDH1A1 (0.39) ALDH1A1
SCHEMBL27801334 0.84 ALDH1A1 (0.31) ALDH1A1
SCHEMBL1195843 0.83 ALDH1A1 (0.34) ALDH1A1
Methacrylic Acid SCHEMBL7899282 0.81 ALDH1A1 (0.44) ALDH1A1
SCHEMBL3084470 0.80 THRB (0.34) ALDH1A1
Methacrylic Acid SCHEMBL6432663 0.79 ALDH1A1 (0.42) ALDH1A1
SCHEMBL30078329 0.77 FNTA (0.40) ALDH1A1
SCHEMBL4436552 0.77 ALDH1A1 (0.34) ALDH1A1
SCHEMBL7091908 0.77 ALDH1A1 (0.34) ALDH1A1

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-8642700-B2 Thermoplastic composition having low gloss and low temperature impact performance BAYER MATERIALSCIENCE LLC (US) 2014-02-04 US claimed
US-20080108751-A1 Thermoplastic composition having low gloss and low temperature impact performance COVESTRO LLC 2008-05-08 US claimed
US-8642700-B2 Thermoplastic composition having low gloss and low temperature impact performance BAYER MATERIALSCIENCE LLC (US) 2014-02-04 US disclosed
US-20080108751-A1 Thermoplastic composition having low gloss and low temperature impact performance COVESTRO LLC 2008-05-08 US disclosed