SCHEMBL5587353

SCHEMBL5587353

Cc1ccc(N=C(c2ccccc2)c2cccc(C(=Nc3ccc(C)cc3C)c3ccccc3)n2)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.41
MAPT P10636 6/20 0.41
ESR2 Q92731 3/20 0.40
ESR1 P03372 2/20 0.40
ALDH1A1 P00352 6/20 0.39
MEN1 O00255 5/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
THRB P10828 2/20 0.38
LMNA P02545 5/20 0.37
HTT P42858 2/20 0.37
GAA P10253 3/20 0.37
KDM4E B2RXH2 2/20 0.37
POLB P06746 1/20 0.37
PKM P14618 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
ALOX12 P18054 1/20 0.37

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
SCHEMBL19887500 1.00 KMT2A (0.41) KMT2AMAPTESR2ESR1ALDH1A1
SCHEMBL5588691 0.99 KMT2A (0.40) KMT2AMAPTESR2ESR1ALDH1A1
SCHEMBL19887501 0.90 SMN1; SMN2 (0.39) KMT2AMAPTALDH1A1MEN1NPC1
SCHEMBL19887497 0.90 SMN1; SMN2 (0.39) KMT2AMAPTALDH1A1MEN1NPC1
SCHEMBL23982592 0.88 KMT2A (0.35) KMT2AMAPTESR2ESR1ALDH1A1
SCHEMBL25876650 0.86 SIGMAR1 (0.43) MAPTESR2ESR1ALDH1A1NPC1
SCHEMBL21078201 0.86 MRGPRX4 (0.38) KMT2AMAPTESR2ESR1ALDH1A1
SCHEMBL21078307 0.86 ESR1 (0.38) KMT2AMAPTESR2ESR1ALDH1A1
SCHEMBL25876649 0.86 MAPT (0.39) KMT2AMAPTESR2ESR1ALDH1A1
SCHEMBL19891796 0.85 MEN1 (0.40) KMT2AMAPTESR2ESR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7247687-B2 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-07-24 US disclosed
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP disclosed
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2006-03-02 US disclosed
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 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-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 KMT2A 1733/4885MAPT 585/4885ESR2 2269/4885

“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.