SCHEMBL4815079

SCHEMBL4815079

CCCCC(CC)COC(=O)/C(C#N)=C/c1ccc(NC(C)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
ALDH1A1 P00352 9/20 0.49
LMNA P02545 4/20 0.49
RAB9A P51151 2/20 0.49
MAPK1 P28482 2/20 0.49
HPGD P15428 2/20 0.47
KMT2A Q03164 2/20 0.44
MAPT P10636 5/20 0.44
TDP1 Q9NUW8 2/20 0.43
CA2 P00918 1/20 0.42
CYP3A4 P08684 1/20 0.42
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PKM P14618 1/20 0.40

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
SCHEMBL4815087 1.00 KDM4E (0.53) KDM4EALDH1A1LMNARAB9AMAPK1
SCHEMBL5408071 1.00 KDM4E (0.53) KDM4EALDH1A1LMNARAB9AMAPK1
SCHEMBL14163363 0.91 ALDH1A1 (0.48) KDM4EALDH1A1LMNARAB9AMAPK1
SCHEMBL10644154 0.90 ALDH1A1 (0.58) KDM4EALDH1A1LMNARAB9AMAPK1
SCHEMBL14400776 0.89 ALDH1A1 (0.46) KDM4EALDH1A1LMNARAB9AMAPK1
SCHEMBL4807659 0.89 ALDH1A1 (0.47) KDM4EALDH1A1LMNARAB9AMAPK1
SCHEMBL4807663 0.89 ALDH1A1 (0.47) KDM4EALDH1A1LMNARAB9AMAPK1
SCHEMBL14163398 0.89 ALDH1A1 (0.47) KDM4EALDH1A1LMNARAB9AMAPK1
SCHEMBL4813060 0.88 ALDH1A1 (0.50) KDM4EALDH1A1LMNARAB9AMAPK1
SCHEMBL4813058 0.88 ALDH1A1 (0.50) KDM4EALDH1A1LMNARAB9AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7390916-B2 Photoprotective cosmetic compositions containing aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile and novel aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile L'OREAL (FR) 2008-06-24 US disclosed
US-7390916-B2 Photoprotective cosmetic compositions containing aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile and novel aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile L'OREAL (FR) 2008-06-24 US disclosed
US-20070249853-A1 Photoprotective cosmetic compositions containing aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile and novel aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile L'OREAL (FR) 2007-10-25 US disclosed
US-20070249853-A1 Photoprotective cosmetic compositions containing aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile and novel aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile L'OREAL (FR) 2007-10-25 US disclosed
US-7255853-B2 Photoprotective cosmetic compositions containing aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile and novel aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile L'OREAL (FR) 2007-08-14 US disclosed
US-7255853-B2 Photoprotective cosmetic compositions containing aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile and novel aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile L'OREAL (FR) 2007-08-14 US disclosed
US-20040175337-A1 Photoprotective cosmetic compositions containing aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile and novel aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile L'OREAL (FR) 2004-09-09 US disclosed
US-6749839-B2 TOPICAL SUNSCREENS FOR HAIR OR SKIN L'OREAL (FR) 2004-06-15 US disclosed
US-20030031691-A1 Photoprotective cosmetic compositions containing aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile and novel aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile L'OREAL (FR) 2003-02-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040175337-A1 Photoprotective cosmetic compositions containing aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile and novel aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile CBR3, CBR1, H1-10 KDM4E 1252/4885ALDH1A1 812/4885LMNA 3014/4885
US-20030031691-A1 Photoprotective cosmetic compositions containing aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile and novel aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile CBR3, CBR1, NAA50 KDM4E 1250/4885ALDH1A1 770/4885LMNA 2803/4885
US-20070249853-A1 Photoprotective cosmetic compositions containing aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile and novel aromatic amide, sulphonamide or carbamate derivatives of acrylonitrile CBR3, C1R, H1-3 KDM4E 1910/4885ALDH1A1 1614/4885LMNA 3198/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.