SCHEMBL1447752

SCHEMBL1447752

CN1CCCN(C(=O)c2ccc(Br)cc2F)CC1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.62
CPS1 P31327 2/20 0.58
KMT2A Q03164 3/20 0.52
EPHX2 P34913 1/20 0.50
HRH4 Q9H3N8 6/20 0.49
MEN1 O00255 1/20 0.49
HRH3 Q9Y5N1 1/20 0.48
CCKBR P32239 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
DGAT1 O75907 1/20 0.45
LMNA P02545 2/20 0.45
TP53 P04637 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 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
SCHEMBL1447852 0.94 CPS1 (0.56) POLBCPS1KMT2AEPHX2HRH4
SCHEMBL643698 0.90 CPS1 (0.60) POLBCPS1KMT2ACCKBRNPC1
SCHEMBL1424241 0.87 CCKBR (0.56) CPS1KMT2ACCKBRNPC1RAB9A
SCHEMBL30791513 0.87 CCKBR (0.56) CPS1KMT2ACCKBRNPC1RAB9A
SCHEMBL969401 0.86 CCKBR (0.58) CPS1KMT2AMEN1CCKBRNPC1
SCHEMBL7870100 0.85 CPS1 (0.59) POLBCPS1KMT2AEPHX2HRH4
SCHEMBL1447805 0.85 POLB (0.68) POLBKMT2AHRH4HRH3NPC1
SCHEMBL17400790 0.84 CPS1 (0.58) POLBCPS1KMT2AEPHX2HRH4
SCHEMBL1447592 0.84 KMT2A (0.67) POLBKMT2AHRH4MEN1HRH3
SCHEMBL13841322 0.80 KDM4E (0.63) CPS1KMT2AEPHX2HRH4MEN1

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
EP-2301928-A1 Imidazolyl-pyrimidine compounds for use in the treatment of proliferative disorders AstraZeneca AB (SE) 2011-03-30 EP disclosed
US-20080280906-A1 Imidazolyl-Pyrimidine Compounds for Use in the Treatment of Proliferative Disorders ASTRAZENECA AB (SE) 2008-11-13 US disclosed
EP-1912974-A1 IMIDAZOLYL-PYRIMIDINE COMPOUNDS FOR USE IN THE TREATMENT OF PROLIFERATIVE DISORDERS AstraZeneca AB (SE) 2008-04-23 EP disclosed
WO-2007015064-A1 IMIDAZOLYL-PYRIMIDINE COMPOUNDS FOR USE IN THE TREATMENT OF PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2007-02-08 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-20080280906-A1 Imidazolyl-Pyrimidine Compounds for Use in the Treatment of Proliferative Disorders CCNI, MKI67, TYMP POLB 50/4885CPS1 234/4885KMT2A 2164/4885

“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.