SCHEMBL4240386

SCHEMBL4240386

Cc1ccccc1NC(=O)C1CC2OC2C(C)C1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.59
LMNA P02545 2/20 0.59
PKM P14618 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.43
HTT P42858 2/20 0.41
TP53 P04637 1/20 0.41
MAPK1 P28482 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
HPGD P15428 2/20 0.40
POLB P06746 1/20 0.40
ITGB3 P05106 1/20 0.39
ITGB1 P05556 1/20 0.39
ITGAV P06756 1/20 0.39
ITGA5 P08648 1/20 0.39
ITGA4 P13612 1/20 0.39

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
SCHEMBL961584 1.00 ALDH1A1 (0.59) ALDH1A1LMNAPKML3MBTL1KDM4E
SCHEMBL2498591 0.80 ALDH1A1 (0.64) ALDH1A1LMNAPKML3MBTL1KDM4E
SCHEMBL1665364 0.73 PPP5C (0.52) ALDH1A1LMNAKDM4ETP53POLB
SCHEMBL4240385 0.70 ALDH1A1 (0.39) ALDH1A1PKML3MBTL1HTTNPC1
SCHEMBL10904284 0.70 ALDH1A1 (0.56) ALDH1A1LMNAPKML3MBTL1KDM4E
SCHEMBL10903893 0.66 ALDH1A1 (0.49) ALDH1A1LMNAPKML3MBTL1KDM4E
SCHEMBL10903793 0.66 POLB (0.53) ALDH1A1LMNAPKML3MBTL1KDM4E
SCHEMBL13342791 0.65 TDP1 (0.60) ALDH1A1LMNAPKML3MBTL1KDM4E
SCHEMBL3494279 0.65 LMNA (0.81) ALDH1A1LMNAPKMKDM4EPOLB
SCHEMBL2235336 0.64 HTT (0.57) ALDH1A1LMNAPKML3MBTL1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8829099-B2 Resin composition and molded article composed of the same TORAY INDUSTRIES, INC. (JP) 2014-09-09 US disclosed
EP-1903077-B1 RESIN COMPOSITION AND MOLDED ARTICLE COMPRISING THE SAME TORAY INDUSTRIES (JP) 2014-09-03 EP disclosed
EP-2740767-A1 Resin composition and molded article comprising of the same TORAY INDUSTRIES, INC. (JP) 2014-06-11 EP disclosed
US-20140155534-A1 RESIN COMPOSITION AND MOLDED ARTICLE COMPOSED OF THE SAME TORAY INDUSTRIES, INC. (JP) 2014-06-05 US disclosed
US-20090030132-A1 Resin Composition and Molded Article Composed of the Same TORAY INDUSTRIES, INC (JP) 2009-01-29 US disclosed
EP-1903077-A1 RESIN COMPOSITION AND MOLDED ARTICLE COMPRISING THE SAME TORAY INDUSTRIES, INC. (JP) 2008-03-26 EP disclosed