SCHEMBL9438232

SCHEMBL9438232

O=C(O)CC(F)(F)C(F)(F)CC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 3/20 0.48
ALDH1A1 P00352 2/20 0.45
HMGCR P04035 1/20 0.45
CHRM1 P11229 1/20 0.45
TBXA2R P21731 1/20 0.45
ADRA1A P35348 1/20 0.45
TSHR P16473 3/20 0.43
CYP2C19 P33261 2/20 0.43
HIF1A Q16665 2/20 0.43
CYP2D6 P10635 1/20 0.43
CPT2 P23786 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
KDM4E B2RXH2 1/20 0.38
FFAR1 O14842 1/20 0.38
LDHA P00338 1/20 0.35
SRR Q9GZT4 1/20 0.35
LMNA P02545 1/20 0.35
ALKBH5 Q6P6C2 1/20 0.35
SUCNR1 Q9BXA5 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35

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
SCHEMBL28665121 0.97 ACLY (0.46) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL11227427 0.87 ACLY (0.44) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL865358 0.87 ACLY (0.44) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL1195706 0.86 ACLY (0.39) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL8562549 0.84 ACLY (0.42) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL28362082 0.84 ACLY (0.48) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL8563267 0.84 ACLY (0.42) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL10385551 0.82 HMGCR (0.50) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL2467083 0.82 ACLY (0.41) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL866292 0.82 ACLY (0.41) ACLYALDH1A1HMGCRCHRM1TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111333497-B Preparation method of fluorine-containing dicarboxylic acid 中蓝晨光化工研究设计院有限公司 2022-12-09 CN disclosed
CN-111333497-A Preparation method of fluorine-containing dicarboxylic acid 中蓝晨光化工研究设计院有限公司 2020-06-26 CN disclosed
EP-0383141-B1 Fluorine-containing alpha,omega-bifunctional compounds and process for their production SAGAMI CHEM RES (JP) 1994-08-03 EP disclosed
US-5151535-A Starting materials for polymers for optical fiber sheaths, membranes or separators SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-09-29 US disclosed
EP-0383141-A2 Fluorine-containing alpha,omega-bifunctional compounds and process for their production SAGAMI CHEMICAL RESEARCH CENTER (JP) 1990-08-22 EP disclosed