SCHEMBL233571

SCHEMBL233571

COC(=O)c1cc(C(=O)c2ccc(N(C)c3ccc(Cl)cc3)cc2)cc([N+](=O)[O-])c1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.55
KMT2A Q03164 7/20 0.55
RECQL P46063 1/20 0.55
LTC4S Q16873 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
MAPT P10636 4/20 0.46
POLB P06746 3/20 0.44
HTT P42858 1/20 0.44
GAA P10253 1/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPK1 P28482 1/20 0.42
ATM Q13315 1/20 0.41
HPGD P15428 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
SCHEMBL232400 0.86 HPGD (0.46) MEN1KMT2ALTC4SSMN1; SMN2MAPT
SCHEMBL229926 0.86 MEN1 (0.57) MEN1KMT2ARECQLSMN1; SMN2MAPT
SCHEMBL229900 0.83 TUBB4A (0.45) MEN1KMT2ALTC4SSMN1; SMN2MAPT
SCHEMBL230032 0.83 MAPT (0.44) MEN1KMT2ALTC4SSMN1; SMN2MAPT
SCHEMBL232232 0.82 LMNA (0.50) MEN1KMT2ALTC4SSMN1; SMN2MAPT
SCHEMBL8762477 0.81 HTT (0.59) MEN1KMT2ARECQLSMN1; SMN2MAPT
SCHEMBL231732 0.79 MEN1 (0.51) MEN1KMT2ARECQLSMN1; SMN2MAPT
SCHEMBL27776291 0.79 ALOX5 (0.56) MEN1KMT2ARECQLSMN1; SMN2MAPT
SCHEMBL232108 0.78 MAPT (0.44) MEN1KMT2ALTC4SSMN1; SMN2MAPT
SCHEMBL231253 0.78 LMNA (0.46) MEN1KMT2ALTC4SSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102341371-A As LTC4Bis-aromatic compounds as synthase inhibitors BIOLIPOX AB (SE) 2012-02-01 CN disclosed
US-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 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-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors LTC4S, LTB4R2, LTB4R MEN1 4355/4885KMT2A 4283/4885RECQL 1021/4885

“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.