SCHEMBL19959100

SCHEMBL19959100

C=C(C)C(=O)Oc1ccc(Oc2c(C)cc(C)cc2C)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
ELANE P08246 2/20 0.49
ATM Q13315 1/20 0.49
LMNA P02545 3/20 0.41
AR P10275 2/20 0.37
THRA P10827 4/20 0.34
THRB P10828 4/20 0.34
MAPT P10636 3/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
MEN1 O00255 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ACHE P22303 1/20 0.33

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
SCHEMBL10013319 0.87 ELANE (0.52) KMT2AELANEATMLMNAAR
SCHEMBL16775425 0.86 PTPN1 (0.39) KMT2AELANEATMLMNAAR
SCHEMBL10013312 0.86 ELANE (0.54) KMT2AELANEATMLMNAAR
SCHEMBL10013305 0.85 KMT2A (0.45) KMT2AELANEATMTHRATHRB
SCHEMBL10013314 0.85 ELANE (0.48) KMT2AELANEATMLMNAAR
SCHEMBL10013302 0.85 KMT2A (0.45) KMT2AELANEATMLMNAAR
SCHEMBL10013301 0.84 KMT2A (0.44) KMT2AELANEATMLMNAAR
SCHEMBL1521059 0.81 ELANE (0.39) KMT2AELANEATMLMNAMAPT
SCHEMBL14173258 0.81 ELANE (0.62) KMT2AELANEATMLMNAMAPT
SCHEMBL14173256 0.81 ELANE (0.62) KMT2AELANEATMLMNAMAPT

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
US-20180077796-A1 RESIN COMPOSITION ELIMINATING VOLATILE LOSS OF INITIATING SPECIES FOR THE PREPARATION OF PRINTED CIRCUIT BOARD LAMINATES INTERNATIONAL BUSINESS MACHINES CORPORATION 2018-03-15 US disclosed