SCHEMBL7563016

SCHEMBL7563016

O=C(N/N=C\c1cccnc1)c1[nH]c2ccccc2c1-c1cccs1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.59
GAA P10253 2/20 0.59
LMNA P02545 2/20 0.59
KDM4E B2RXH2 2/20 0.59
HPGD P15428 1/20 0.59
MAPT P10636 3/20 0.58
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
HTT P42858 1/20 0.51
RAB9A P51151 4/20 0.50
POLB P06746 2/20 0.46
ASF1A Q9Y294 1/20 0.45
THRB P10828 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
SCHEMBL7563020 1.00 ALDH1A1 (0.59) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL7560504 0.86 MAPT (0.55) ALDH1A1GAALMNAKDM4EMAPT
SCHEMBL7560498 0.86 MAPT (0.55) ALDH1A1GAALMNAKDM4EMAPT
SCHEMBL7560540 0.85 LMNA (0.61) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL7560543 0.85 LMNA (0.61) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL7559063 0.85 MEN1 (0.51) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL7559066 0.85 MEN1 (0.51) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL7536867 0.83 MAPT (0.57) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL7673313 0.83 MAPT (0.57) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL7675474 0.83 MAPT (0.57) ALDH1A1GAALMNAKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020091148-A1 3-substituted indole antiproliferative angiogenesis inhibitors ABBOTT LABORATORIES 2002-07-11 US claimed
WO-2002022576-A2 3-SUBSTITUTED INDOLE CARBOHYDRAZIDES USEFUL AS CELL PROLIFERATION AND ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2002-03-21 WO claimed
US-20020091148-A1 3-substituted indole antiproliferative angiogenesis inhibitors ABBOTT LABORATORIES 2002-07-11 US disclosed
WO-2002022576-A2 3-SUBSTITUTED INDOLE CARBOHYDRAZIDES USEFUL AS CELL PROLIFERATION AND ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2002-03-21 WO 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-20020091148-A1 3-substituted indole antiproliferative angiogenesis inhibitors MKI67, FLT4, IDO1 ALDH1A1 98/4885GAA 3668/4885LMNA 4535/4885

“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.