SCHEMBL9250353

SCHEMBL9250353

CC(C)COC(=O)c1cc(F)c(F)cc1Cl

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.63
LMNA P02545 1/20 0.63
MAPT P10636 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
GAA P10253 2/20 0.53
TSHR P16473 2/20 0.53
ALDH1A1 P00352 2/20 0.53
CYP1A2 P05177 1/20 0.52
CYP2C19 P33261 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.44
PKM P14618 1/20 0.44
POLB P06746 1/20 0.44
APEX1 P27695 1/20 0.44
GUSB P08236 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
KDM4E B2RXH2 1/20 0.42
KMT2A Q03164 1/20 0.41
GPR35 Q9HC97 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40

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
SCHEMBL9247853 0.92 LMNA (0.55) HPGDLMNAMAPTSMN1; SMN2GAA
SCHEMBL2549970 0.81 LMNA (0.60) HPGDLMNAMAPTSMN1; SMN2GAA
SCHEMBL4627854 0.81 ALDH1A1 (0.61) HPGDLMNAMAPTSMN1; SMN2GAA
SCHEMBL19795501 0.80 ALDH1A1 (0.56) HPGDLMNAMAPTSMN1; SMN2TSHR
SCHEMBL9248670 0.79 CYP1A2 (0.60) HPGDLMNAMAPTSMN1; SMN2GAA
SCHEMBL9247954 0.78 HPGD (0.56) HPGDLMNAMAPTSMN1; SMN2GAA
SCHEMBL21866043 0.77 ALDH1A1 (0.57) HPGDMAPTSMN1; SMN2TSHRALDH1A1
SCHEMBL827863 0.77 TSHR (0.70) LMNAMAPTSMN1; SMN2TSHRALDH1A1
SCHEMBL9244541 0.76 CYP1A2 (0.65) HPGDLMNAMAPTSMN1; SMN2GAA
SCHEMBL1110997 0.75 GAA (0.57) HPGDLMNAMAPTSMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0355774-B1 Nucleus-fluorinated aromatic carboxylates and processes for their production ASAHI GLASS CO LTD (JP) 1995-04-26 EP disclosed
US-4985588-A Nucleus-fluorinated aromatic carboxylates and processes for their production ASAHI GLASS COMPANY LTD. (JP) 1991-01-15 US disclosed
EP-0355774-A2 Nucleus-fluorinated aromatic carboxylates and processes for their production ASAHI GLASS COMPANY LTD. (JP) 1990-02-28 EP disclosed