SCHEMBL10973409

SCHEMBL10973409

CC(C)(Cc1ccc(CCl)cc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 2/20 0.46
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
PTGES2 Q9H7Z7 3/20 0.40
GRN P28799 1/20 0.40
SORT1 Q99523 1/20 0.40
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
KDM4E B2RXH2 3/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
EGFR P00533 1/20 0.39
FYN P06241 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
SCHEMBL28185714 0.85 BLM (0.43) BLMPTGES2GRNSORT1CYP4F2
SCHEMBL6469200 0.84 GRN (0.54) BLMPTGES2GRNSORT1KDM4E
SCHEMBL27925093 0.83 ESR1 (0.56) BLMPTGES2GRNSORT1CYP4F2
SCHEMBL4457891 0.82 BLM (0.47) BLMPTGES2KDM4ECYP1A2HPGD
SCHEMBL11596247 0.82 BLM (0.67) BLMCA2CYP4F2CYP4A11KDM4E
SCHEMBL6668736 0.82 BLM (0.52) BLMCYP4F2CYP4A11KDM4ECYP1A2
SCHEMBL517462 0.81 SMN1; SMN2 (0.57) BLMCYP1A2CYP3A4ALDH1A1RECQL
SCHEMBL5149405 0.80 BLM (0.46) BLMCYP4F2CYP4A11KDM4ECYP1A2
SCHEMBL8494644 0.80 SLC13A5 (0.50) BLMCA1CA2PTGES2SMN1; SMN2
SCHEMBL5394972 0.80 PPARG (0.49) BLMPTGES2CYP4F2CYP4A11KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4539383-A COLOR PHOTOGRAPHY POLAROID CORPORATION (US) 1985-09-03 US disclosed
US-4424272-A CARBONYLOXYBENZYL QUATERNARY AMMONIUM-SUBSTITUTED ACRYLAMIDE POLYMER POLAROID CORPORATION (US) 1984-01-03 US disclosed