SCHEMBL11211368

SCHEMBL11211368

O=C(c1ccccc1)c1ccc(F)cc1SC(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.54
LMNA P02545 2/20 0.54
MAPK1 P28482 2/20 0.54
HTT P42858 2/20 0.54
TSHR P16473 1/20 0.54
GAA P10253 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
KMT2A Q03164 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
KCNK2 O95069 1/20 0.41
ABCC9 O60706 2/20 0.40
ABCC8 Q09428 2/20 0.40
KCNJ11 Q14654 2/20 0.40
KCNJ8 Q15842 2/20 0.40
AKR1C3 P42330 1/20 0.40
MAPK14 Q16539 2/20 0.39
ALDH1A1 P00352 2/20 0.38

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
SCHEMBL10937151 0.81 MEN1 (0.44) MAPTLMNAMAPK1HTTTSHR
SCHEMBL25902691 0.76 KMT2A (0.54) MAPTLMNAMAPK1HTTTSHR
SCHEMBL29765677 0.75 CES2 (0.59) MAPTLMNAGAAKDM4EMEN1
SCHEMBL158348 0.75 CES2 (0.59) MAPTLMNAGAAKDM4EMEN1
SCHEMBL5155478 0.74 AKR1C3 (0.62) MAPTGAAKDM4EMEN1USP2
SCHEMBL5389980 0.74 GAA (0.68) MAPTLMNAMAPK1HTTTSHR
SCHEMBL5155352 0.74 KDM4E (0.68) MAPTGAAKDM4EMEN1USP2
SCHEMBL30070815 0.74 GAA (0.68) MAPTLMNAMAPK1HTTTSHR
SCHEMBL10935425 0.73 ELANE (0.47) MAPTLMNAMAPK1HTTTSHR
SCHEMBL11638597 0.72 MAPT (0.49) MAPTGAAKDM4EMEN1USP2

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
EP-0085265-A1 Process for the preparation of alpha,alpha-difluoroalkoxy or alpha,alpha-difluoroalkylthiophenyl ketones RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1983-08-10 EP disclosed