SCHEMBL9344459

SCHEMBL9344459

CCC(C)NC(=O)C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
PKM P14618 1/20 0.47
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47
MMP3 P08254 1/20 0.47
ESR1 P03372 1/20 0.44
KCNH2 Q12809 1/20 0.44
CA2 P00918 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA9 Q16790 1/20 0.40
EPHX1 P07099 2/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 3/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 2/20 0.37
MLYCD O95822 1/20 0.35
KDM4C Q9H3R0 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
SCHEMBL7230655 0.83 ALDH1A1 (0.46) SMN1; SMN2ESR1KCNH2CA2EPHX1
SCHEMBL8060275 0.82 ESR1 (0.44) SMN1; SMN2ESR1KCNH2CA2CA12
SCHEMBL31496034 0.82 ESR1 (0.44) SMN1; SMN2ESR1KCNH2CA2CA12
SCHEMBL8060272 0.82 ESR1 (0.44) SMN1; SMN2ESR1KCNH2CA2CA12
SCHEMBL25134681 0.80 MLYCD (0.53) SMN1; SMN2MMP1MMP2ESR1KCNH2
SCHEMBL28012919 0.80 ESR1 (0.43) SMN1; SMN2ESR1KCNH2CA2CA12
SCHEMBL12204111 0.80 MLYCD (0.53) SMN1; SMN2MMP1MMP2ESR1KCNH2
SCHEMBL19699581 0.79 MMP1 (0.48) SMN1; SMN2PKMMMP1MMP2MMP3
SCHEMBL8114734 0.79 MMP1 (0.48) SMN1; SMN2PKMMMP1MMP2MMP3
SCHEMBL19699582 0.79 MMP1 (0.48) SMN1; SMN2PKMMMP1MMP2MMP3

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-0339284-B1 Fluorine-containing dielectric media and capacitors employing such media ATOCHEM NORTH AMERICA (US) 1994-06-29 EP disclosed
US-4899249-A Fluorine-containing dielectric media and capacitors employing such media PENNWALT CORPORATION (US) 1990-02-06 US disclosed
EP-0339284-A1 Fluorine-containing dielectric media and capacitors employing such media ATOCHEM NORTH AMERICA, INC. (a Pennsylvania corp.) (US) 1989-11-02 EP disclosed