SCHEMBL16639591

SCHEMBL16639591

C=C(C)C(=O)Oc1cc(C)c(OC(=O)C(=C)C)c(C)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.45
KMT2A Q03164 4/20 0.41
ATM Q13315 2/20 0.41
ALDH1A1 P00352 3/20 0.37
HTT P42858 2/20 0.34
HSD17B10 Q99714 2/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
TSHR P16473 2/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
POLB P06746 2/20 0.32
BACE1 P56817 1/20 0.32
ACHE P22303 1/20 0.32
LMNA P02545 2/20 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
SCHEMBL14191590 0.93 KMT2A (0.41) ELANEKMT2AATMALDH1A1HTT
SCHEMBL1521059 0.86 ELANE (0.39) ELANEKMT2AATMALDH1A1HTT
SCHEMBL17433296 0.86 ELANE (0.39) ELANEKMT2AATMALDH1A1HTT
SCHEMBL9627001 0.86 ELANE (0.46) ELANEKMT2AATMALDH1A1HTT
SCHEMBL18328824 0.85 CYP3A4 (0.38) ELANEKMT2AATMALDH1A1HTT
SCHEMBL92324 0.85 ELANE (0.45) ELANEKMT2AATMALDH1A1HSD17B10
SCHEMBL16775425 0.84 PTPN1 (0.39) ELANEKMT2AATMALDH1A1HTT
SCHEMBL20436164 0.84 ATM (0.37) ELANEKMT2AATMALDH1A1HTT
SCHEMBL15357797 0.83 ELANE (0.53) ELANEKMT2AATMALDH1A1HTT
SCHEMBL21033549 0.83 ELANE (0.49) ELANEKMT2AATMHTTHSD17B10

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-20180163023-A1 THERMOSETTING RESIN COMPOSITION NAN YA PLASTICS CORPORATION (TW) 2018-06-14 US disclosed
US-20150105505-A1 Varnishes and Prepregs and Laminates Made Therefrom CERBERUS BUSINESS FINANCE, LLC, AS COLLATERAL AGENT (FIRST LIEN) 2015-04-16 US disclosed