SCHEMBL16619909

SCHEMBL16619909

CCOC(=O)n1ccc2cc(OC(F)(F)F)ccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.49
POLB P06746 2/20 0.44
CACNA1H O95180 1/20 0.42
TUBB1 Q9H4B7 1/20 0.41
HRH2 P25021 1/20 0.41
HRH1 P35367 1/20 0.41
ALOX5 P09917 1/20 0.41
PLA2G10 O15496 1/20 0.41
PLA2G2A P14555 1/20 0.41
LMNA P02545 2/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PIM1 P11309 1/20 0.39
BRD4 O60885 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
CHRNA7 P36544 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
MAOA P21397 1/20 0.39

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
SCHEMBL2720556 0.84 KCNQ3 (0.47) ELANECACNA1HTUBB1PLA2G10PLA2G2A
SCHEMBL2119201 0.83 TUBB1 (0.56) ELANEPOLBTUBB1LMNAALDH1A1
SCHEMBL2651525 0.82 PIM1 (0.47) ELANETUBB1PLA2G10PLA2G2APIM1
SCHEMBL24110372 0.80 TUBB1 (0.39) ELANECACNA1HTUBB1PLA2G10PLA2G2A
SCHEMBL2116459 0.79 TFPI2 (0.47) ELANEPOLBLMNAALDH1A1SMN1; SMN2
SCHEMBL24110386 0.78 MAOA (0.39) ELANECACNA1HTUBB1PLA2G10PLA2G2A
SCHEMBL24110343 0.78 MAOA (0.39) ELANECACNA1HTUBB1PLA2G10PLA2G2A
SCHEMBL24110340 0.78 MAOA (0.39) ELANECACNA1HTUBB1PLA2G10PLA2G2A
SCHEMBL2115772 0.77 CA12 (0.44) ELANELMNAALDH1A1SMN1; SMN2KDM4E
SCHEMBL7483288 0.76 PRKCI (0.47) ELANELMNASMN1; SMN2KDM4EMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3052495-A1 NOVEL BICYCLIC PYRIDINONES AS GAMMA-SECRETASE MODULATORS Pfizer Inc. (US) 2016-08-10 EP disclosed
WO-2015049616-A1 NOVEL BICYCLIC PYRIDINONES AS GAMMA-SECRETASE MODULATORS PFIZER INC. (US) 2015-04-09 WO disclosed