SCHEMBL6131142

SCHEMBL6131142

CCCCC(CC)CCC(F)(F)C(F)(F)C(F)(F)F.[NaH]

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
TDP1 Q9NUW8 2/20 0.41
CYP3A4 P08684 4/20 0.39
TSHR P16473 3/20 0.39
CA2 P00918 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.34
ATM Q13315 1/20 0.32
OPRM1 P35372 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
SCHEMBL25175963 0.76
SCHEMBL19861785 0.74 ALDH1A1 (0.54) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL7719962 0.73 CES2 (0.32) TSHR
SCHEMBL3884493 0.72 ALDH1A1 (0.68) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL19619509 0.71 LMNA (0.45) TSHROPRM1
SCHEMBL18639144 0.71 LMNA (0.45) TSHROPRM1
SCHEMBL14879730 0.71 CES2 (0.40) TSHR
SCHEMBL30119959 0.70 ACE2 (0.31) OPRM1
SCHEMBL524297 0.70 ALDH1A1 (0.65) ALDH1A1TDP1CYP3A4TSHRCA2
Water SCHEMBL9947734 0.70 ALDH1A1 (0.65) ALDH1A1TDP1CYP3A4TSHRCA2

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-20050069824-A1 Silver halide color photosensitive material FUJI PHOTO FILM CO., LTD. 2005-03-31 US disclosed
US-20040137386-A1 Silver halide color photographic lightsensitive material FUJI PHOTO FILM CO., LTD. 2004-07-15 US disclosed
US-20040048209-A1 Antistatic property and shows reduced repellency during high speed coating, and can be stably produced FUJI PHOTO FILM CO., LTD. 2004-03-11 US disclosed