SCHEMBL6749402

SCHEMBL6749402

Cc1cc(C)n(CN(Cn2nc(C)cc2C)C(C)C)n1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 3/20 0.50
GLA P06280 1/20 0.50
LMNA P02545 4/20 0.49
APAF1 O14727 1/20 0.49
POLB P06746 1/20 0.49
GLS O94925 1/20 0.48
PKM P14618 1/20 0.41
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL348053 0.79 ALDH1A1 (0.57) ALDH1A1KDM4EGLALMNAAPAF1
SCHEMBL18157935 0.78 ALDH1A1 (0.55) ALDH1A1KDM4EGLALMNAAPAF1
SCHEMBL2608929 0.74 LMNA (0.62) ALDH1A1KDM4EGLALMNAAPAF1
SCHEMBL10277762 0.73
SCHEMBL17489160 0.72 GLS (0.75) ALDH1A1KDM4EGLALMNAAPAF1
SCHEMBL16447617 0.72 ALDH1A1 (0.64) ALDH1A1KDM4EGLALMNAAPAF1
Hydrochloric Acid SCHEMBL464810 0.71 ALDH1A1 (0.57) ALDH1A1KDM4EGLALMNAAPAF1
SCHEMBL14578729 0.71 LMNA (0.64) ALDH1A1KDM4EGLALMNAAPAF1
SCHEMBL13045167 0.71 GLS (0.60) ALDH1A1KDM4EGLALMNAAPAF1
SCHEMBL13633143 0.71 LMNA (0.59) ALDH1A1KDM4EGLALMNAAPAF1

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
US-20040082464-A1 Complex polymerization catalysts for the homopolymerization of ethylene and for the copolymerization of ethylene POLIMERI EUROPA S.P.A. (IT) 2004-04-29 US disclosed
EP-1268500-A1 COMPLEX POLYMERIZATION CATALYSTS FOR THE HOMOPOLYMERIZATION OF ETHYLENE AND FOR THE COPOLYMERIZATION OF ETHYLENE Polimeri Europa S.p.A. (IT) 2003-01-02 EP disclosed
WO-2001074831-A1 COMPLEX POLYMERIZATION CATALYSTS FOR THE HOMOPOLYMERIZATION OF ETHYLENE AND FOR THE COPOLYMERIZATION OF ETHYLENE POLIMERI EUROPA S.P.A. (IT) 2001-10-11 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-20040082464-A1 Complex polymerization catalysts for the homopolymerization of ethylene and for the copolymerization of ethylene ETV6, MVD, ELL ALDH1A1 2491/4885KDM4E 1274/4885GLA 2945/4885

“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.