SCHEMBL5752969

SCHEMBL5752969

COc1ccc(CC(=O)NN)cc1C#N

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
CACNA1H O95180 7/20 0.51
KDM4E B2RXH2 2/20 0.49
USP2 O75604 1/20 0.49
EPHX2 P34913 1/20 0.45
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
AOC2 O75106 1/20 0.43
CTSD P07339 1/20 0.43
POLB P06746 1/20 0.43
KDM1A O60341 1/20 0.43

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
SCHEMBL5739424 0.84 ALDH1A1 (0.55) ALDH1A1CACNA1HKDM4EUSP2GAA
SCHEMBL5320828 0.82 GAA (0.62) ALDH1A1KDM4EUSP2GAA
SCHEMBL31432862 0.82 ALDH1A1 (0.56) ALDH1A1CACNA1HKDM4EUSP2GAA
SCHEMBL602779 0.82 EPHX2 (0.62) ALDH1A1KDM4EEPHX2GAAKMT2A
SCHEMBL19338412 0.80 ALDH1A1 (0.53) ALDH1A1CACNA1HKDM4EEPHX2GAA
SCHEMBL5747672 0.80 ERCC1 (0.45) ALDH1A1KDM4EGAACYP1A2AOC2
SCHEMBL17730692 0.78 HTT (0.50) ALDH1A1CACNA1HKDM4EEPHX2GAA
SCHEMBL13568602 0.78 ALDH1A1 (0.55) ALDH1A1KDM4EUSP2KMT2ACYP1A2
SCHEMBL20349602 0.78 ALDH1A1 (0.48) ALDH1A1KDM4EUSP2GAAKMT2A
SCHEMBL6783952 0.76 KDM4E (0.61) ALDH1A1KDM4EUSP2GAAKMT2A

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
EP-1644362-A2 INDOLINONE HYDRAZIDES AS C-MET INHIBITORS Sugen, Inc. (US) 2006-04-12 EP disclosed
US-20060009493-A1 Indolinone hydrazides as c-Met inhibitors SUGEN, INC. 2006-01-12 US disclosed
WO-2005005378-A2 INDOLINONE HYDRAZIDES AS C-MET INHIBITORS SUGEN, INC. (US) 2005-01-20 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-20060009493-A1 Indolinone hydrazides as c-Met inhibitors MET, IGF1R, ROS1 ALDH1A1 143/4885CACNA1H 2602/4885KDM4E 861/4885

“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.