SCHEMBL7048034

SCHEMBL7048034

OC(F)(F)C(F)(F)C1CC2C=CC1C2

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
HIF1A Q16665 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
PTGS2 P35354 1/20 0.34
HRH1 P35367 1/20 0.34
KCNH2 Q12809 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
GAA P10253 1/20 0.33

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
SCHEMBL3880292 0.82 LMNA (0.36) ALDH1A1TDP1USP2LMNAKDM4E
SCHEMBL200337 0.82 KDM4E (0.32) ALDH1A1TDP1USP2LMNAKDM4E
SCHEMBL4415495 0.80 KDM4E (0.31) ALDH1A1TDP1LMNAKDM4EGAA
SCHEMBL11921079 0.78 ALDH1A1 (0.35) ALDH1A1TDP1USP2LMNAKDM4E
SCHEMBL18714194 0.78 ALDH1A1 (0.35) ALDH1A1TDP1USP2LMNAKDM4E
SCHEMBL75227 0.78 ALDH1A1 (0.35) ALDH1A1TDP1USP2LMNAKDM4E
SCHEMBL13324798 0.78 ALDH1A1 (0.35) ALDH1A1TDP1USP2LMNAKDM4E
SCHEMBL15362615 0.77
SCHEMBL24643274 0.77 LMNA (0.34) ALDH1A1TDP1USP2LMNAKDM4E
SCHEMBL203770 0.77 LMNA (0.34) ALDH1A1TDP1USP2LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030219680-A1 Photoresists useful for microfabrication utilizing deep ultraviolet rays such as an excimer laser, x-rays such as synchrotron radiation, and electron beams JSR CORPORATION (JP) 2003-11-27 US disclosed