SCHEMBL9893038

SCHEMBL9893038

CCC1CCCN1C(=O)N1CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.46
KMT2A Q03164 1/20 0.46
RECQL P46063 1/20 0.45
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
POLB P06746 2/20 0.44
CNR2 P34972 2/20 0.43
HTT P42858 1/20 0.41
TSHR P16473 1/20 0.41
MAPT P10636 1/20 0.40
CYP1A2 P05177 1/20 0.40
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40

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
SCHEMBL12204157 0.82 L3MBTL1 (0.41) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL8520603 0.81 CA2 (0.46) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL19071348 0.80 MEN1 (0.46) MEN1TP53KMT2ARECQLPOLB
SCHEMBL9893028 0.79 CNR2 (0.44) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL16480463 0.78 MEN1 (0.50) MEN1TP53KMT2ARECQLPOLB
SCHEMBL28070422 0.77 KMT2A (0.53) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL9891865 0.74 MEN1 (0.46) MEN1TP53KMT2ARECQLCNR2
SCHEMBL3708847 0.73 MEN1 (0.48) MEN1TP53KMT2ACNR2
SCHEMBL16254877 0.73 MEN1 (0.48) MEN1TP53KMT2ARECQLALDH1A1
SCHEMBL3708845 0.73 MEN1 (0.48) MEN1TP53KMT2ACNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 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 (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-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 MEN1 4874/4885TP53 4450/4885KMT2A 3551/4885

“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.