SCHEMBL823153

SCHEMBL823153

CNC(=O)c1ccc2c3ccc(C(=O)O)c4c(C(=O)NC)ccc(c5ccc(C(=O)O)c1c52)c43

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.54
PLK1 P53350 4/20 0.42
NEU3 Q9UQ49 1/20 0.41
GAA P10253 2/20 0.40
BRD4 O60885 1/20 0.37
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
MAPK10 P53779 1/20 0.35
NR4A2 P43354 1/20 0.35
KMT2A Q03164 2/20 0.34
MTNR1A P48039 1/20 0.34
HSD17B10 Q99714 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL11520918 1.00 CYP1A2 (0.54) CYP1A2PLK1NEU3GAABRD4
SCHEMBL2100060 1.00 CYP1A2 (0.54) CYP1A2PLK1NEU3GAABRD4
SCHEMBL30101142 1.00 CYP1A2 (0.54) CYP1A2PLK1NEU3GAABRD4
SCHEMBL823142 0.92 CYP1A2 (0.64) CYP1A2PLK1NEU3GAABRD4
SCHEMBL12021877 0.92 CYP1A2 (0.64) CYP1A2PLK1NEU3GAABRD4
SCHEMBL4959993 0.92 CYP1A2 (0.64) CYP1A2PLK1NEU3GAABRD4
SCHEMBL12038232 0.87 CYP1A2 (0.41) CYP1A2PLK1NEU3GAABRD4
SCHEMBL12180026 0.87 CYP1A2 (0.41) CYP1A2PLK1NEU3GAABRD4
SCHEMBL12038247 0.87 CYP1A2 (0.41) CYP1A2PLK1NEU3GAABRD4
SCHEMBL30141 0.83 CYP1A2 (0.78) CYP1A2GAANR4A2KMT2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8314265-B2 Aromatic amic acids or amic esters and compositions EASTMAN KODAK COMPANY (US) 2012-11-20 US disclosed
US-20110269967-A1 AROMATIC AMIC ACIDS OR AMIC ESTERS AND COMPOSITIONS BANK OF AMERICA, N.A., AS AGENT 2011-11-03 US disclosed
US-20110269966-A1 SEMICONDUCTING ARTICLES CITICORP NORTH AMERICA, INC., AS AGENT 2011-11-03 US disclosed
US-20110269265-A1 METHODS OF PREPARING SEMICONDUCTIVE COMPOSITIONS AND DEVICES KODAK REALTY INC. 2011-11-03 US disclosed
US-20110266523-A1 SEMICONDUCTING DEVICES AND METHODS OF PREPARING BANK OF AMERICA, N.A., AS AGENT 2011-11-03 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 (2 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-20110269966-A1 SEMICONDUCTING ARTICLES ALAD, PORCN, DDC CYP1A2 498/4885PLK1 4353/4885NEU3 3664/4885
US-20110269967-A1 AROMATIC AMIC ACIDS OR AMIC ESTERS AND COMPOSITIONS DDC, AADAC, MYOC CYP1A2 155/4885PLK1 4884/4885NEU3 2145/4885

“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.