SCHEMBL7048196

SCHEMBL7048196

Cc1cc(Sc2cc(C)c(OCCO)c(C)c2)cc(C)c1OCCO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.43
BRD4 O60885 1/20 0.38
KMT2A Q03164 4/20 0.38
THRB P10828 3/20 0.38
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 3/20 0.37
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
GAA P10253 2/20 0.36
HSD17B10 Q99714 1/20 0.36
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35

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
SCHEMBL3398525 0.81 HTR1A (0.58) HTR1ABRD4KMT2AALDH1A1KDM4E
SCHEMBL16638364 0.79 HTR1A (0.36) HTR1ABRD4KMT2ATHRBALDH1A1
SCHEMBL10358895 0.78 SCN4A (0.49) HTR1ABRD4KMT2AKDM4EMEN1
SCHEMBL7044002 0.78 HTR1A (0.44) HTR1ABRD4KMT2ATHRBALDH1A1
SCHEMBL11703620 0.78 HTR1A (0.44) HTR1ABRD4KMT2ATHRBALDH1A1
SCHEMBL25193508 0.78 HTR1A (0.44) HTR1ABRD4KMT2ATHRBALDH1A1
SCHEMBL3182203 0.78 KMT2A (0.53) HTR1ABRD4KMT2ATHRBALDH1A1
SCHEMBL347042 0.76 HTR1A (0.43) HTR1ABRD4KMT2ATHRBALDH1A1
SCHEMBL8201459 0.76 HTR1A (0.43) HTR1ABRD4KMT2AALDH1A1KDM4E
SCHEMBL16448973 0.76 BRD4 (0.53) HTR1ABRD4KMT2AALDH1A1KDM4E

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
EP-0751183-B1 Thermo-shrinkable polyester films TOYO BOSEKI (JP) 2003-04-09 EP disclosed
EP-0271928-B1 Thermo-shrinkable polyester film TOYO BOSEKI (JP) 1997-04-16 EP disclosed
EP-0751183-A2 A polyester composition used for thermoshrinkable films Toyo Boseki Kabushiki Kaisha (JP) 1997-01-02 EP disclosed
US-4996291-A Wrapping material TOYO BOSEKI KABUSHIKI KAISHA (JP) 1991-02-26 US disclosed