SCHEMBL6353679

SCHEMBL6353679

O=C1Nc2ccccc2C1=C1C=Cc2cc(OCC[N+]3([O-])CC[S+]([O-])CC3)ccc2N1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 1/20 0.33
MAOB P27338 2/20 0.32
MAOA P21397 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL6353675 1.00 MDM2 (0.33) MDM2MAOBMAOAALDH1A1MAPT
SCHEMBL6354674 0.79 MDM2 (0.40) MDM2MAOBMAOAALDH1A1MAPT
SCHEMBL6354675 0.79 MDM2 (0.40) MDM2MAOBMAOAALDH1A1MAPT
SCHEMBL6353249 0.74 PTPN7 (0.42) MAOBMAOAALDH1A1MAPTSMN1; SMN2
SCHEMBL6353252 0.74 PTPN7 (0.42) MAOBMAOAALDH1A1MAPTSMN1; SMN2
SCHEMBL1250660 0.73 FLT3 (0.50) ALDH1A1
SCHEMBL1250665 0.73 FLT3 (0.50) ALDH1A1
SCHEMBL6355225 0.73 ALDH1A1 (0.41) MDM2MAOBMAOAALDH1A1MAPT
SCHEMBL6355223 0.73 ALDH1A1 (0.41) MDM2MAOBMAOAALDH1A1MAPT
Hydrochloric Acid SCHEMBL6353019 0.71 SLC6A2 (0.46) MAOBMAOA

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
US-20050090498-A1 3-Quinolin-2(1h)-ylideneindolin-2-one derivative YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2005-04-28 US disclosed
EP-1396490-A1 3-QUINOLINE-2-(1H)-YLIDENEINDOLIN-2-ONE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2004-03-10 EP 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-20050090498-A1 3-Quinolin-2(1h)-ylideneindolin-2-one derivative KDR, FLT4, FLT1 MDM2 801/4885MAOB 4555/4885MAOA 4445/4885

“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.