SCHEMBL28895362

SCHEMBL28895362

CC(=O)C(C(=O)C(F)(F)F)c1ccc(F)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC11 Q96DB2 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ HDAC9 Q9UKV0 1/20 0.39
▸ HDAC5 Q9UQL6 1/20 0.39
▸ PLOD2 O00469 1/20 0.37
▸ ESR1 P03372 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ HTT P42858 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ ALPG P10696 1/20 0.35
▸ POLB P06746 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
SCHEMBL19437959 0.84 HDAC3 (0.47) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL2082953 0.83 SRC (0.48) HDAC3HDAC4HDAC1HDAC6LMNA
SCHEMBL27444155 0.81 SRC (0.47) HDAC3HDAC4HDAC1HDAC6LMNA
Hydrochloric Acid SCHEMBL27461611 0.80 SRC (0.45) HDAC3HDAC4HDAC1HDAC6LMNA
SCHEMBL28437637 0.80 HDAC4 (0.45) HDAC4HDAC7HDAC5CES2CES1
SCHEMBL7821350 0.79 SRC (0.46) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL3497505 0.77 GRM7 (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL27542241 0.75 UGT2B7 (0.46) —
SCHEMBL17290963 0.74 ALDH1A1 (0.47) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL7779630 0.74 NR3C1 (0.38) PLOD2HTTALDH1A1LMNASMN1; SMN2

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
CN-108085490-B Extraction composition and method for enriching lithium 青海恒信融锂业科技有限公司 2020-04-28 — — CN disclosed
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