SCHEMBL7564271

SCHEMBL7564271

O=C(O)c1ccccc1-c1cccc(P)c1-c1ccccc1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.59
ALDH1A1 P00352 4/20 0.55
LMNA P02545 2/20 0.55
MAPT P10636 2/20 0.55
HNF4A P41235 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.50
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
ALOX12 P18054 1/20 0.49
ALOX15 P16050 1/20 0.48
FOLH1 Q04609 2/20 0.46
GAA P10253 1/20 0.46
HSD17B10 Q99714 1/20 0.46
HDAC8 Q9BY41 1/20 0.45
SOS1 Q07889 1/20 0.44
KMT2A Q03164 1/20 0.42
HTT P42858 1/20 0.42
NR4A1 P22736 1/20 0.42
NR4A2 P43354 1/20 0.42
NR4A3 Q92570 1/20 0.42

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
SCHEMBL31540338 0.88 MYC (0.68) MYCALDH1A1LMNAMAPTHNF4A
SCHEMBL160565 0.88 MYC (0.68) MYCALDH1A1LMNAMAPTHNF4A
SCHEMBL5089936 0.86 ALDH1A1 (0.66) MYCALDH1A1LMNAMAPTHNF4A
SCHEMBL15656677 0.83 MYC (0.44) MYCALDH1A1LMNAMAPTHNF4A
SCHEMBL11217790 0.81 MYC (0.69) MYCALDH1A1LMNAMAPTHNF4A
SCHEMBL30028907 0.81 ALDH1A1 (0.72) MYCALDH1A1LMNAMAPTHNF4A
SCHEMBL36145 0.81 ALDH1A1 (0.72) MYCALDH1A1LMNAMAPTHNF4A
Hydrochloric Acid SCHEMBL7579852 0.79 ALDH1A1 (0.68) MYCALDH1A1LMNAMAPTHNF4A
SCHEMBL2830888 0.79 ALDH1A1 (0.68) MYCALDH1A1LMNAMAPTHNF4A
Hydrochloric Acid SCHEMBL1681943 0.79 ALDH1A1 (0.68) MYCALDH1A1LMNAMAPTHNF4A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0697014-B2 PROCESS FOR THE PREPARATION OF A LINEAR ALDEHYDE ORGANIC COMPOUND DSM NV (NL) 2002-08-28 EP disclosed
US-5811589-A ISOMERIZING AN INTERNALLY UNSATURATED FUNCTIONALIZED ORGANIC COMPOUND TO A TERMINALLY UNSATURATED ONE; HYDROFORMYLATION IN THE PRESENCE OF CARBON MONOXIDE, HYDROGEN AND A CATALYST DSM N.V. (NL) 1998-09-22 US disclosed
EP-0697014-B1 PROCESS FOR THE PREPARATION OF A LINEAR ALDEHYDE ORGANIC COMPOUND DSM NV (NL) 1998-06-10 EP disclosed
EP-0697014-A1 PROCESS FOR THE PREPARATION OF A LINEAR ALDEHYDE ORGANIC COMPOUND DSM N.V. (NL) 1996-02-21 EP disclosed
WO-1994026688-A1 PROCESS FOR THE PREPARATION OF A LINEAR ALDEHYDE ORGANIC COMPOUND DSM N.V. (NL) 1994-11-24 WO disclosed
EP-0218100-B1 CONJUGATED ALKADIENE TELOMERIZATION TO ORGANO-OXYALKADIENES QUANTUM CHEMICAL CORPORATION (a Virginia corp.) (US) 1989-11-29 EP disclosed
EP-0218100-A1 Conjugated alkadiene telomerization to organo-oxyalkadienes QUANTUM CHEMICAL CORPORATION (a Virginia corp.) (US) 1987-04-15 EP disclosed