SCHEMBL515912

SCHEMBL515912

O=C(O)CN(CC(=O)O)c1cccc(Oc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPOR P19235 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.50
AKR1C3 P42330 1/20 0.50
CETP P11597 6/20 0.49
DAGLA Q9Y4D2 2/20 0.46
NR3C1 P04150 1/20 0.46
ERCC5 P28715 1/20 0.45
FEN1 P39748 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL515961 0.84 SMN1; SMN2 (0.62) EPORSMN1; SMN2NR3C1ALDH1A1
SCHEMBL9795739 0.84 EPOR (0.51) EPORSMN1; SMN2AKR1C3DAGLAERCC5
SCHEMBL342248 0.83 LMNA (0.54)
SCHEMBL340808 0.82 CRHBP (0.47) ALDH1A1
SCHEMBL516646 0.82 EPOR (0.40) EPORSMN1; SMN2CETPDAGLA
SCHEMBL17975523 0.78 MTNR1A (0.52)
SCHEMBL202173 0.78 TDP1 (0.50) SMN1; SMN2ALDH1A1
SCHEMBL1025218 0.77 KMO (0.44) CETPERCC5FEN1HDAC8
SCHEMBL11735577 0.77 ALDH1A1 (0.55) SMN1; SMN2CETPKDM4EALDH1A1
SCHEMBL14611444 0.77 PLA2G2A (0.66)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046739-B1 SUBSTITUTED ANILINE DERIVATIVES UCB BIOPHARMA SPRL (BE) 2015-08-26 EP disclosed
EP-2046739-B1 SUBSTITUTED ANILINE DERIVATIVES UCB BIOPHARMA SPRL (BE) 2015-08-26 EP disclosed
US-8624022-B2 Substituted aniline derivatives UCB PHARMA, S.A. (BE) 2014-01-07 US disclosed
US-8624022-B2 Substituted aniline derivatives UCB PHARMA, S.A. (BE) 2014-01-07 US disclosed
US-8624022-B2 Substituted aniline derivatives UCB PHARMA, S.A. (BE) 2014-01-07 US disclosed
US-20120029188-A1 Substituted Aniline Derivatives UCB PHARMA S.A. (BE) 2012-02-02 US disclosed
US-20120029188-A1 Substituted Aniline Derivatives UCB PHARMA S.A. (BE) 2012-02-02 US disclosed
US-20120029188-A1 Substituted Aniline Derivatives UCB PHARMA S.A. (BE) 2012-02-02 US disclosed
US-8071582-B2 Substituted aniline derivatives UCB PHARMA S.A. (BE) 2011-12-06 US disclosed
US-8071582-B2 Substituted aniline derivatives UCB PHARMA S.A. (BE) 2011-12-06 US disclosed
US-20110014271-A1 Substituted Aniline Derivatives UCB PHARMA S.A. (BE) 2011-01-20 US disclosed
US-7678785-B2 Substituted aniline derivatives UCB PHARMA S.A. (BE) 2010-03-16 US disclosed
US-7678785-B2 Substituted aniline derivatives UCB PHARMA S.A. (BE) 2010-03-16 US disclosed
US-7678785-B2 Substituted aniline derivatives UCB PHARMA S.A. (BE) 2010-03-16 US disclosed
EP-2046739-A1 SUBSTITUTED ANILINE DERIVATIVES UCB Pharma S.A. (BE) 2009-04-15 EP disclosed
US-20080045497-A1 SUBSTITUTED ANILINE DERIVATIVES UCB PHARMA S.A. (BE) 2008-02-21 US disclosed
US-20080045497-A1 SUBSTITUTED ANILINE DERIVATIVES UCB PHARMA S.A. (BE) 2008-02-21 US disclosed
US-20080045497-A1 SUBSTITUTED ANILINE DERIVATIVES UCB PHARMA S.A. (BE) 2008-02-21 US disclosed
WO-2008012524-A1 SUBSTITUTED ANILINE DERIVATIVES UCB PHARMA S.A. (BE) 2008-01-31 WO disclosed
WO-2008012524-A1 SUBSTITUTED ANILINE DERIVATIVES UCB PHARMA S.A. (BE) 2008-01-31 WO 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-20120029188-A1 Substituted Aniline Derivatives NAT1, DPM1, IL4I1 EPOR 1905/4885SMN1; SMN2 2874/4885AKR1C3 761/4885
US-20080045497-A1 SUBSTITUTED ANILINE DERIVATIVES DPM1, ERG28, IL4I1 EPOR 2726/4885SMN1; SMN2 2292/4885AKR1C3 409/4885
US-20110014271-A1 Substituted Aniline Derivatives NAT1, DPM1, IL4I1 EPOR 1905/4885SMN1; SMN2 2874/4885AKR1C3 761/4885

“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.