SCHEMBL4286491

SCHEMBL4286491

O=C(c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)s1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.59
MAOB P27338 1/20 0.59
SRD5A2 P31213 2/20 0.53
ALDH1A1 P00352 2/20 0.51
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51
CES1 P23141 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MAPK1 P28482 2/20 0.49
POLB P06746 1/20 0.49
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
TSHR P16473 1/20 0.47
MAPT P10636 1/20 0.46
F2 P00734 1/20 0.46
DAO P14920 1/20 0.46
CES2 O00748 1/20 0.45

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
SCHEMBL15201517 0.77 MAOA (0.56) MAOAMAOBALDH1A1LMNAGAA
SCHEMBL10723714 0.76 SRD5A2 (0.83) SRD5A2ALDH1A1LMNAGAACES1
SCHEMBL975118 0.76 SRD5A2 (0.83) SRD5A2ALDH1A1LMNAGAACES1
SCHEMBL9694902 0.76 ALDH1A1 (0.54) SRD5A2ALDH1A1LMNAGAACES1
SCHEMBL1810147 0.75 SRD5A2 (0.69) MAOAMAOBSRD5A2ALDH1A1LMNA
SCHEMBL9151459 0.75 DAO (0.61) MAOAALDH1A1GAAPOLBTDP1
SCHEMBL9144815 0.74 F2 (0.70) MAOAMAOBALDH1A1LMNAGAA
SCHEMBL12496213 0.74 APP (0.55) MAOAMAOBSRD5A2ALDH1A1LMNA
SCHEMBL27600575 0.73 POLB (0.74) SRD5A2ALDH1A1LMNAGAACES1
SCHEMBL11708498 0.72 MAOA (0.58) MAOAMAOBALDH1A1LMNAGAA

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
US-8232402-B2 Quinolinone farnesyl transferase inhibitors for the treatment of synucleinopathies and other indications LINK MEDICINE CORPORATION (US) 2012-07-31 US disclosed
WO-2009151683-A2 QUINOLINONE FARNESYL TRANSFERASE INHIBITORS FOR THE TREATMENT OF SYNUCLEINOPATHIES AND OTHER INDICATIONS LINK MEDICINE CORPORATION (US) 2009-12-17 WO disclosed
US-20090253655-A1 QUINOLINONE FARNESYL TRANSFERASE INHIBITORS FOR THE TREATMENT OF SYNUCLEINOPATHIES AND OTHER INDICATIONS ASTRAZENECA AB (SE) 2009-10-08 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-20090253655-A1 QUINOLINONE FARNESYL TRANSFERASE INHIBITORS FOR THE TREATMENT OF SYNUCLEINOPATHIES AND OTHER INDICATIONS PANK1, PANK3, PANK2 MAOA 641/4885MAOB 851/4885SRD5A2 3685/4885

“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.