SCHEMBL3845875

SCHEMBL3845875

C=C(C)COc1ccc(C23CC4CC(CC(C4)C2C2C4CC5CC(C4)CC2(c2ccc(OCC(=C)C)cc2OCC(=C)C)C5)C3)c(OCC(=C)C)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.33
MEN1 O00255 8/20 0.33
HTR2B P41595 2/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 7/20 0.33
MAPT P10636 7/20 0.33
NPSR1 Q6W5P4 7/20 0.33
TSHR P16473 5/20 0.33
TP53 P04637 4/20 0.33
LMNA P02545 4/20 0.33
HPGD P15428 3/20 0.33
USP2 O75604 2/20 0.33
CASP1 P29466 2/20 0.33
CASP7 P55210 2/20 0.33
POLB P06746 2/20 0.33
PKM P14618 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX5AP P20292 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
SCHEMBL3844403 0.82 MEN1 (0.45) KMT2AMEN1RAB9AALDH1A1LMNA
SCHEMBL3841450 0.79 ADRA2A (0.39) KMT2AMEN1HTR2BHTR2AHTR2C
SCHEMBL3844863 0.76 GSTP1 (0.33) HTR2BHTR2AHTR2C
SCHEMBL3845879 0.74 EPHX2 (0.32) MAPTTP53LMNAPOLB
SCHEMBL6579897 0.64 ESR1 (0.56) KMT2AMEN1RAB9AALDH1A1LMNA
SCHEMBL9622079 0.64 LMNA (0.52) KMT2AMEN1RAB9AALDH1A1MAPT
SCHEMBL3845593 0.63 HSP90AA1 (0.39) KMT2AMEN1ALDH1A1MAPTHPGD
SCHEMBL10338925 0.63 GPR174 (0.58) KMT2AMEN1ALDH1A1MAPTNPSR1
SCHEMBL3844825 0.62 ADRA2A (0.33)
SCHEMBL3849672 0.62

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-20090318610-A1 ORGANIC INSULATING MATERIALS, VARNISHES FOR ORGANIC INSULATING FILM EMPLOYING THEM, ORGANIC INSULATING FILMS AND SEMICONDUCTOR DEVICES SUMITOMO BAKELITE CO., LTD (JP) 2009-12-24 US disclosed
EP-2117009-A1 ORGANIC INSULATING MATERIAL, VARNISH FOR ORGANIC INSULATING FILM USING THE SAME, ORGANIC INSULATING FILM AND SEMICONDUCTOR DEVICE Sumitomo Bakelite Co., Ltd. (JP) 2009-11-11 EP disclosed