SCHEMBL20146658

SCHEMBL20146658

Cc1ccc2c(c1)C(C)(c1ccccc1)c1ccccc1O2

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
GAA P10253 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
KMT2A Q03164 1/20 0.33
PDK2 Q15119 1/20 0.33
MAPT P10636 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
MAOB P27338 2/20 0.32
KIF11 P52732 1/20 0.32
AHR P35869 1/20 0.31
MGAM O43451 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
MAOA P21397 1/20 0.31
TP53 P04637 1/20 0.30

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
SCHEMBL15713397 0.86 MMP2 (0.41) LMNAGAAMMP2MMP9MAOB
SCHEMBL2035718 0.84 P2RX4 (0.37) LMNANPSR1MAPT
SCHEMBL15713413 0.83 AHR (0.49) LMNAGAANPSR1KMT2APDK2
SCHEMBL21309291 0.82 LMNA (0.36) LMNAGAANPSR1KMT2APDK2
SCHEMBL23861584 0.80 ALOX5 (0.39) MMP2MMP9MAOBAHRMAOA
SCHEMBL5467986 0.80 GAA (0.36) LMNAGAANPSR1KMT2APDK2
SCHEMBL9188443 0.80 GAA (0.38) LMNAGAANPSR1KMT2APDK2
SCHEMBL25852206 0.78 PDK2 (0.38) PDK2
SCHEMBL24145317 0.78 PDK2 (0.38) LMNAGAAKMT2APDK2AHR
SCHEMBL25851904 0.77 PDK2 (0.34) LMNAKMT2APDK2MAPT

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-2917198-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-05-16 EP disclosed