SCHEMBL6865548

SCHEMBL6865548

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

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
ESR1 P03372 2/20 0.35
ESR2 Q92731 2/20 0.35
CTSC P53634 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL7787968 0.72 ALDH1A1 (0.37) ALDH1A1ESR1ESR2
SCHEMBL13958798 0.71 ALDH1A1 (0.35) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL24146430 0.70 ALDH1A1 (0.52) ALDH1A1CTSCTDP1
SCHEMBL2773245 0.70 ALDH1A1 (0.34) ALDH1A1ESR1ESR2
SCHEMBL22317484 0.69 ALDH1A1 (0.41) ALDH1A1TDP1
SCHEMBL4907665 0.68 ALDH1A1 (0.44) ALDH1A1ESR1ESR2CTSCTDP1
SCHEMBL2772308 0.68 ALDH1A1 (0.39) ALDH1A1ESR1ESR2
SCHEMBL570118 0.67 ALDH1A1 (0.48) ALDH1A1ESR1ESR2TDP1
SCHEMBL18084878 0.66 ALDH1A1 (0.33) ALDH1A1
SCHEMBL2773876 0.66 ALDH1A1 (0.37) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6800418-B2 ALLOWING DEVELOPMENT WITH CONVENTIONAL DEVELOPERS AND HAVING A HIGH TRANSMITTANCE AT A F2 EXCIMER LASER WAVELENGTH OF 157 NM, HYDROPHILICITY, ADHESION TO UNDERLAYER SAMSUNG ELECTRONICS (KR) 2004-10-05 US disclosed
US-20030157430-A1 Fluorine-containing photosensitive polymer having hydrate structure and resist composition comprising the same SAMSUNG ELECTRONICS CO., LTD. 2003-08-21 US disclosed