SCHEMBL244729

SCHEMBL244729

CC(C)(C)CC(C)(C)c1ccc(O)c(-c2ccccc2-c2c[nH]nn2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.40
CYP2D6 P10635 2/20 0.40
HIF1A Q16665 1/20 0.40
SHBG P04278 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
MAPK1 P28482 2/20 0.37
USP2 O75604 2/20 0.37
TP53 P04637 2/20 0.37
MAPT P10636 2/20 0.37
ESR1 P03372 1/20 0.37
PGR P06401 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
AR P10275 1/20 0.37
DRD1 P21728 1/20 0.37
PTGS1 P23219 1/20 0.37
SLC6A2 P23975 1/20 0.37
PDE4A P27815 1/20 0.37
CASP1 P29466 1/20 0.37

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
SCHEMBL669252 0.86 MEN1 (0.44) CYP3A4CYP2D6SMN1; SMN2MEN1KMT2A
SCHEMBL5806307 0.82 SHBG (0.33) SHBGCNR1CNR2
SCHEMBL1743018 0.80 SHBG (0.31) SHBG
SCHEMBL7699366 0.78 SHBG (0.59) CYP3A4CYP2D6HIF1ASHBGSMN1; SMN2
SCHEMBL30987016 0.78 CYP3A4 (0.38) CYP3A4CYP2D6HIF1ASHBGSMN1; SMN2
SCHEMBL29238423 0.78 CYP3A4 (0.38) CYP3A4CYP2D6HIF1ASHBGSMN1; SMN2
SCHEMBL1743527 0.78 ALDH1A1 (0.31) CYP3A4ESR1CNR1CNR2ALDH1A1
SCHEMBL304360 0.76 HPGD (0.48) CYP3A4SMN1; SMN2MEN1KMT2AUSP2
SCHEMBL28717515 0.76 IDH1 (0.34) CYP3A4HIF1ASHBGALDH1A1HSP90AA1
SCHEMBL27169616 0.75 CYP3A4 (0.46) CYP3A4CYP2D6HIF1ASHBGSMN1; SMN2

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 122 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3044208-B1 OXIME ESTER PHOTOINITIATORS BASF SE (DE) 2021-12-22 EP disclosed
US-11168228-B2 Ink, image forming method, image forming device, and recorded matter RICOH COMPANY, LTD. (JP) 2021-11-09 US disclosed
WO-2021143348-A1 PPS COMPOSITION AND PREPARATION METHOD THEREFOR 金发科技股份有限公司 2021-07-22 WO disclosed
WO-2021036615-A1 POLYPROPYLENE-POLYPHENYLENE ETHER-POLYSTYRENE TERNARY ALLOY AND PREPARATION METHOD THEREFOR 金发科技股份有限公司 2021-03-04 WO disclosed
WO-2020207235-A1 POLYFORMALDEHYDE COMPOSITE MATERIAL, PREPARATION METHOD THEREFOR AND USE OF SEBS AS MATTING AGENT IN POLYFORMALDEHYDE 金发科技股份有限公司 2020-10-15 WO disclosed
WO-2020186977-A1 POLYPROPYLENE COMPOSITION AND PREPARATION METHOD THEREFOR 金发科技股份有限公司 2020-09-24 WO disclosed
US-20190300731-A1 INK, IMAGE FORMING METHOD, IMAGE FORMING DEVICE, AND RECORDED MATTER RICOH COMPANY, LTD. (JP) 2019-10-03 US disclosed
EP-3405519-A1 ADDITIVE MIXTURE FOR STABILIZATION OF POLYOL AND POLYURETHANE BASF SE (DE) 2018-11-28 EP disclosed
EP-3334780-A1 3-PHENYL-BENZOFURAN-2-ONE DERIVATIVES CONTAINING PHOSPHORUS AS STABILIZERS BASF SE (DE) 2018-06-20 EP disclosed
US-9982151-B2 Aqueous ink for inkjet, inkjet recording method, inkjet recorded matter, and inkjet recording device RICOH COMPANY, LTD. (JP) 2018-05-29 US disclosed
EP-0670843-A1 ALPHA CRYSTALLINE MODIFICATION OF 2,2',2\"-NITRILO TRIETHYL-TRIS-(3,3',5,5'-TETRA-TERT-BUTYL-1,1'-BIPHENYL-2,2'-DIYL)PHOSPHITE]. CIBA GEIGY AG (CH) 1995-09-13 EP disclosed
WO-1995023176-A1 INCREASING THE MOLECULAR WEIGHT OF POLYESTERS CIBA-GEIGY AG (CH) 1995-08-31 WO disclosed
EP-0662105-A1 PROCESS FOR THE STABILIZATION OF AND STABILIZER MIXTURES FOR SINGLE-MATERIAL RECYCLED PLASTICS Ciba SC Holding AG (CH) 1995-07-12 EP disclosed
EP-0658156-A1 HYDROXYPHENYL-S-TRIAZINES Ciba SC Holding AG (CH) 1995-06-21 EP disclosed
WO-1995005387-A1 GAMMA CRYSTALLINE MODIFICATION OF 2,2',2'-NITRILO[TRIETHYL-TRIS-(3,3',5,5'-TETRA-TERT-BUTYL-1,1'-BIPHENYL-2,2'-DIYL)PHOSPHITE] CIBA-GEIGY AG (CH) 1995-02-23 WO disclosed
WO-1994024188-A1 INCREASING THE MOLECULAR WEIGHT OF POLYESTERS AND PREMIX USEFUL FOR THIS PROCESS CIBA-GEIGY AG (CH) 1994-10-27 WO disclosed
WO-1994012508-A1 BETA CRYSTALLINE MODIFICATION OF 2,2',2''-NITRILO[TRIETHYL-TRIS-(3,3',5,5'-TETRA-TERT-BUTYL-1,1'-BIPHENYL-2,2'-DIYL) PHOSPHITE] CIBA-GEIGY AG (CH) 1994-06-09 WO disclosed
WO-1994012509-A1 ALPHA CRYSTALLINE MODIFICATION OF 2,2',2'-NITRILO[TRIETHYL-TRIS-(3,3',5,5'-TETRA-TERT-BUTYL-1,1'-BIPHENYL-2,2'-DIYL)PHOSPHITE] CIBA-GEIGY AG (CH) 1994-06-09 WO disclosed
WO-1994007951-A1 PROCESS FOR THE STABILIZATION OF AND STABILIZER MIXTURES FOR SINGLE-MATERIAL RECYCLED PLASTICS CIBA-GEIGY AG (CH) 1994-04-14 WO disclosed
WO-1994005645-A1 HYDROXYPHENYL-S-TRIAZINES CIBA-GEIGY AG (CH) 1994-03-17 WO disclosed