SCHEMBL20764182

SCHEMBL20764182

CN1CCc2c1ccc1[nH]c(C(=O)Oc3c(F)c(F)c(F)c(F)c3F)cc21

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 8/20 0.41
BAZ2B Q9UIF8 3/20 0.37
MAPKAPK2 P49137 1/20 0.36
POLB P06746 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GAA P10253 1/20 0.35
PRKCB P05771 1/20 0.34
HDAC1 Q13547 2/20 0.34

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
SCHEMBL13183208 0.94 HRH4 (0.39) HRH4BAZ2BMAPKAPK2POLBKDM4E
SCHEMBL13183290 0.88 HRH4 (0.39) HRH4POLBKDM4EALDH1A1ALOX15
SCHEMBL20764389 0.83 RAB9A (0.41) HRH4BAZ2BPOLB
SCHEMBL20764411 0.83 BTK (0.35) HRH4POLBKDM4EALDH1A1ALOX15
SCHEMBL889807 0.81 HRH4 (0.41) HRH4BAZ2BMAPKAPK2POLBGAA
SCHEMBL3419669 0.81 KDM4E (0.44) HRH4BAZ2BMAPKAPK2POLBKDM4E
SCHEMBL3494654 0.81 HRH4 (0.35) HRH4BAZ2BPOLBKDM4EALDH1A1
SCHEMBL20764323 0.80 HRH4 (0.46) HRH4BAZ2BPOLB
SCHEMBL14356123 0.79 MEN1 (0.35) HRH4POLBKDM4EALDH1A1ALOX15
SCHEMBL15031239 0.79 RAB9A (0.43) HRH4MAPKAPK2POLBKDM4EALDH1A1

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
WO-2019036225-A1 DUPLEX STABILIZING FLUORESCENCE QUENCHERS FOR NUCLEIC ACID PROBES ELITECHGROUP, INC. (US) 2019-02-21 WO disclosed