SCHEMBL6355223

SCHEMBL6355223

O=C1Nc2ccccc2/C1=C1\C=Cc2cc(OCC3CO3)ccc2N1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
TP53 P04637 3/20 0.41
TSHR P16473 3/20 0.41
HIF1A Q16665 2/20 0.41
CYP3A4 P08684 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
MAPT P10636 5/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
PKM P14618 2/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
FGFR1 P11362 1/20 0.35
SRC P12931 1/20 0.35
POLB P06746 1/20 0.35
CASP3 P42574 2/20 0.34
CASP7 P55210 2/20 0.34

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
SCHEMBL6355225 1.00 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2TP53TSHRHIF1A
Hydrochloric Acid SCHEMBL6353019 0.83 SLC6A2 (0.46) TDP1MAOAMAOB
Hydrochloric Acid SCHEMBL6353016 0.83 SLC6A2 (0.46) TDP1MAOAMAOB
SCHEMBL6360871 0.81 MAOA (0.41) ALDH1A1SMN1; SMN2MAPTMAOAMAOB
SCHEMBL6360867 0.81 MAOA (0.41) ALDH1A1SMN1; SMN2MAPTMAOAMAOB
SCHEMBL6354675 0.81 MDM2 (0.40) ALDH1A1SMN1; SMN2MAPTMAOAMAOB
SCHEMBL6354674 0.81 MDM2 (0.40) ALDH1A1SMN1; SMN2MAPTMAOAMAOB
SCHEMBL6353249 0.80 PTPN7 (0.42) ALDH1A1SMN1; SMN2MAPTMAOAMAOB
SCHEMBL6353252 0.80 PTPN7 (0.42) ALDH1A1SMN1; SMN2MAPTMAOAMAOB
SCHEMBL1250665 0.77 FLT3 (0.50) ALDH1A1TP53TSHRHPGDPPARG

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 ALDH1A1 1986/4885SMN1; SMN2 4586/4885TP53 209/4885

“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.