SCHEMBL20100726

SCHEMBL20100726

Fc1ccc(N(c2ccc(F)cc2)c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(N(c4ccc(F)cc4)c4ccc(F)cc4)ccc2-3)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 12/20 0.41
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
OPRK1 P41145 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GPR3 P46089 1/20 0.33
CES1 P23141 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32

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
SCHEMBL14073186 0.97 PDK2 (0.40) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL808117 0.93 PDK2 (0.46) PDK2
SCHEMBL16996419 0.93 MEN1 (0.39) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL20100706 0.92 PDK2 (0.39) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL16996392 0.91 PDK2 (0.39) PDK2MEN1KMT2ACES1ESR1
SCHEMBL20218276 0.91 PDK2 (0.36) PDK2
SCHEMBL20100715 0.91 PDK2 (0.33) PDK2
SCHEMBL16996129 0.91 MEN1 (0.40) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL17804600 0.90 MEN1 (0.42) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL19886943 0.90 PDK2 (0.40) PDK2KDM4EMAPTKMT2A

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
US-20180122587-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-05-03 US disclosed
US-20180122587-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-05-03 US disclosed