SCHEMBL1845008

SCHEMBL1845008

N[C@H]1[C@@H]2CC3C[C@H]1C[C@@](CNC(=O)OCc1ccccc1)(C3)C2

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.59
P2RX7 Q99572 7/20 0.54
KDM1A O60341 3/20 0.48
MAOA P21397 2/20 0.48
MAOB P27338 2/20 0.48
RCOR1 Q9UKL0 2/20 0.47
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PRKCQ Q04759 1/20 0.44

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
SCHEMBL12578532 1.00 EPHX2 (0.59) EPHX2P2RX7KDM1AMAOAMAOB
SCHEMBL1845006 1.00 EPHX2 (0.59) EPHX2P2RX7KDM1AMAOAMAOB
SCHEMBL1845011 1.00 EPHX2 (0.59) EPHX2P2RX7KDM1AMAOAMAOB
SCHEMBL12578534 0.88 EPHX2 (0.57) EPHX2P2RX7KDM1AMAOAMAOB
SCHEMBL1845763 0.86 EPHX2 (0.54) EPHX2P2RX7LMNASMN1; SMN2MEN1
SCHEMBL1845764 0.86 EPHX2 (0.54) EPHX2P2RX7LMNASMN1; SMN2MEN1
SCHEMBL974457 0.82 EPHX2 (0.51) EPHX2KDM1AMAOAMAOBRCOR1
SCHEMBL10297219 0.82 EPHX2 (0.51) EPHX2KDM1AMAOAMAOBRCOR1
SCHEMBL973910 0.82 EPHX2 (0.51) EPHX2KDM1AMAOAMAOBRCOR1
SCHEMBL1847869 0.82 EPHX2 (0.57) EPHX2P2RX7LMNASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110159019-A1 2,4-DIAMINOPYRIMIDINE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-30 US disclosed
EP-2325175-A1 2,4-DIAMINOPYRIMIDINE COMPOUND Astellas Pharma Inc. (JP) 2011-05-25 EP 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-20110159019-A1 2,4-DIAMINOPYRIMIDINE COMPOUND PRKCZ, DCLK1, AAK1 EPHX2 2166/4885P2RX7 952/4885KDM1A 1714/4885

“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.