SCHEMBL2932649

SCHEMBL2932649

O=C(O)C(=O)CC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(F)cc2c1=O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.58
TP53 P04637 1/20 0.56
MAPT P10636 5/20 0.53
PRNP P04156 1/20 0.53
GAA P10253 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
RXFP1 Q9HBX9 1/20 0.50
CNR2 P34972 1/20 0.49
POLB P06746 3/20 0.48
IDO1 P14902 1/20 0.48
SERPINE1 P05121 1/20 0.47

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
SCHEMBL2937844 0.91 MEN1 (0.62) THRBTP53MAPTPRNPMEN1
SCHEMBL2935721 0.89 TP53 (0.51) THRBTP53MAPTPRNPGAA
SCHEMBL2935928 0.89 TP53 (0.71) TP53MAPTSMN1; SMN2CNR2POLB
SCHEMBL2937117 0.85 THRB (0.62) THRBTP53MAPTPRNPGAA
SCHEMBL7188052 0.82 POLB (0.67) TP53MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL2937922 0.81 LMNA (0.57) TP53SMN1; SMN2CNR2
SCHEMBL2936959 0.81 MEN1 (0.48) THRBTP53MAPTPRNPMEN1
SCHEMBL2935498 0.80 CHRM1 (0.63) TP53MAPTSMN1; SMN2CNR2POLB
SCHEMBL2930243 0.80 LMNA (0.71) TP53CNR2
SCHEMBL2935649 0.79 CHRM1 (0.51) TP53MAPTSMN1; SMN2CNR2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1730135-B1 QIUNOLIN-4-ONES AS INHIBITORS OF RETROVIRAL INTEGRASE FOR THE TREATMENT OF HIV, AIDS AND AIDS RELATED COMPLEX (ARC) US OF AMERICA REPRESENTED BY T (US) 2010-09-22 EP disclosed
US-7776883-B2 Quinolin-4-ones as inhibitors of retroviral integrase for the treatment of HIV, AIDS and AIDS related complex (ARC) THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2010-08-17 US disclosed
US-20070219242-A1 Quinolin-4-Ones as Inhibitors of Retroviral Integrase for the Treatment of Hiv, Aids and Aids Related Complex (Arc) GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES, THE 2007-09-20 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 (1 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-20070219242-A1 Quinolin-4-Ones as Inhibitors of Retroviral Integrase for the Treatment of Hiv, Aids and Aids Related Complex (Arc) QTRT1, QTRT2, CTCF THRB 4067/4885TP53 3949/4885MAPT 1583/4885

“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.