SCHEMBL2693183

SCHEMBL2693183

O=C(O)c1c(C(=O)O)c(C(F)(F)F)c2c(c1C(F)(F)F)C(=O)OC2=O

nearest known ligand 0.30

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.30
APAF1 O14727 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
TSHR P16473 2/20 0.30
CYP1A2 P05177 1/20 0.30
GPR35 Q9HC97 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
SCHEMBL1100208 0.78 GPR35 (0.33) SMN1; SMN2TSHRGPR35
SCHEMBL436571 0.77 GPR35 (0.38) ALDH1A1SMN1; SMN2TSHRCYP1A2GPR35
SCHEMBL1634950 0.74 GPR35 (0.36) ALDH1A1SMN1; SMN2TSHRCYP1A2GPR35
SCHEMBL15697317 0.73 ASPH (0.38) ALDH1A1
SCHEMBL1077861 0.72 ALDH1A1 (0.38) ALDH1A1APAF1NPC1LMNAMAPT
SCHEMBL31634630 0.72 ALDH1A1 (0.38) ALDH1A1APAF1NPC1LMNAMAPT
SCHEMBL9142308 0.71 GPR35 (0.38) ALDH1A1SMN1; SMN2TSHRCYP1A2GPR35
SCHEMBL28995828 0.71 FABP4 (0.41) ALDH1A1LMNAMAPTHTT
Hydrochloric Acid SCHEMBL9344466 0.69 GPR35 (0.36) ALDH1A1SMN1; SMN2TSHRCYP1A2GPR35
SCHEMBL31244452 0.69 GPR35 (0.36) ALDH1A1SMN1; SMN2TSHRCYP1A2GPR35

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
US-8668992-B2 Fluorinated polyimides with fluorene cardo structure as optical materials that have low absolute thermo-optic coefficients BREWER SCIENCE INC. (US) 2014-03-11 US disclosed
US-20120308835-A1 FLUORINATED POLYIMIDES WITH FLUORENE CARDO STRUCTURE AS OPTICAL MATERIALS THAT HAVE LOW ABSOLUTE THERMO-OPTIC COEFFICIENTS BREWER SCIENCE INC. (US) 2012-12-06 US disclosed
US-8168327-B2 Imide derivative, material for organic electroluminescent device and organic electroluminescent device using the same IDEMITSU KOSAN CO., LTD. (JP) 2012-05-01 US disclosed
US-20070160905-A1 NOVEL IMIDE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-07-12 US disclosed