SCHEMBL4097765

SCHEMBL4097765

Cc1cc(Oc2c(C3CC3)nn(CCO)c2C)cc(C)c1C#N

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
BRD4 O60885 1/20 0.33
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
MAPT P10636 1/20 0.32
AXL P30530 1/20 0.31
MERTK Q12866 1/20 0.31
KDM1A O60341 1/20 0.31
PDE10A Q9Y233 1/20 0.31

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
SCHEMBL4110176 0.90 KDM4E (0.34) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL3133937 0.88 KCNH2 (0.36) KDM1APDE10A
SCHEMBL509673 0.85 KCNH2 (0.41) KDM1A
SCHEMBL4103586 0.84 PKM (0.32) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL4102620 0.84 ALDH1A1 (0.35) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL4609481 0.83 PGR (0.39) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL4114900 0.82 KDM4E (0.35) KDM4EMEN1KMT2ABRD4ALDH1A1
SCHEMBL4104626 0.82 PGR (0.42) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL13889226 0.82 KDM4E (0.39) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL4752257 0.82 PDE10A (0.34) KDM4EMEN1KMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099209-A1 Compounds Useful in Therapy PFIZER INC 2009-04-16 US disclosed
US-20090099209-A1 Compounds Useful in Therapy PFIZER INC 2009-04-16 US disclosed
US-7482375-B2 Compounds useful in therapy PFIZER INC. (US) 2009-01-27 US disclosed
US-7482375-B2 Compounds useful in therapy PFIZER INC. (US) 2009-01-27 US disclosed
EP-1874732-A1 PYRAZOLE DERIVATIVES AS PROGESTERONE RECEPTOR ANTAGONISTS Pfizer Limited (GB) 2008-01-09 EP disclosed
WO-2006111856-A1 PYRAZOLE DERIVATIVES AS PROGESTERONE RECEPTOR ANTAGONISTS PFIZER LIMITED (GB) 2006-10-26 WO disclosed
US-20060241125-A1 Compounds useful in therapy BRADLEY PAUL A 2006-10-26 US 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 (2 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-20060241125-A1 Compounds useful in therapy CBR3, GPER1, CBR1 KDM4E 3328/4885MEN1 2554/4885KMT2A 3171/4885
US-20090099209-A1 Compounds Useful in Therapy CBR3, CBR1, GPER1 KDM4E 3493/4885MEN1 2898/4885KMT2A 3346/4885

“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.