SCHEMBL2930484

SCHEMBL2930484

CCOC(=O)C(=O)CC(=O)c1cn(Cc2ccc(F)cc2)c2cc(N3CCCC3)ccc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
MAPT P10636 4/20 0.45
POLB P06746 1/20 0.45
THRB P10828 2/20 0.44
PRNP P04156 1/20 0.44
P2RX3 P56373 1/20 0.44
LMNA P02545 1/20 0.43
CNR1 P21554 2/20 0.43
CNR2 P34972 2/20 0.43
USP10 Q14694 1/20 0.43
TOP1 P11387 2/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL2931083 0.88 MEN1 (0.61) MEN1KMT2AMAPTPOLBTHRB
SCHEMBL2936959 0.88 MEN1 (0.48) MEN1KMT2AMAPTPOLBTHRB
SCHEMBL13177826 0.85 MEN1 (0.55) MEN1KMT2AMAPTPOLBTHRB
SCHEMBL2935939 0.83 THRB (0.51) MEN1KMT2AMAPTPOLBTHRB
SCHEMBL2937117 0.83 THRB (0.62) MEN1KMT2AMAPTPOLBTHRB
SCHEMBL2937575 0.83 TP53 (0.61) MAPTPOLBTHRBLMNACNR2
SCHEMBL2937713 0.76 CHRM1 (0.54) MEN1KMT2AMAPTPOLBTHRB
SCHEMBL2936544 0.75 CHRM1 (0.44) MEN1KMT2AMAPTPOLBTHRB
SCHEMBL2937266 0.75 ALDH1A1 (0.53) MAPTLMNACNR2TP53
SCHEMBL2937566 0.75 LMNA (0.61) LMNACNR1CNR2TP53

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 MEN1 4566/4885KMT2A 134/4885MAPT 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.