SCHEMBL13698473

SCHEMBL13698473

CC1CCC(N2CCN(c3ccccc3F)CC2)CC1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
GLA P06280 1/20 0.50
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ABCB1 P08183 1/20 0.48
HSD17B10 Q99714 1/20 0.48
LMNA P02545 1/20 0.47
POLB P06746 2/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL13698464 0.84 ABCB1 (0.62) MEN1KMT2AGLAKDM4EALDH1A1
SCHEMBL13698472 0.84 HSD17B10 (0.51) MEN1KMT2AGLAKDM4EALDH1A1
SCHEMBL5460658 0.83 GAA (0.62) MEN1KMT2AGLAKDM4EALDH1A1
SCHEMBL13698476 0.82 ALDH1A1 (0.70) MEN1KMT2AALDH1A1SMN1; SMN2POLB
SCHEMBL14768684 0.80 KDM4E (0.51) MEN1KMT2AGLAKDM4EALDH1A1
SCHEMBL13468008 0.79 L3MBTL3 (0.59) MEN1KMT2AGLAKDM4EABCB1
SCHEMBL999259 0.77 GAA (0.47) MEN1KMT2AGLAKDM4EALDH1A1
SCHEMBL27851348 0.77 GAA (0.47) MEN1KMT2AGLAKDM4EALDH1A1
SCHEMBL737747 0.77 GRIN2B (0.65) MEN1KMT2AKDM4EALDH1A1POLB
SCHEMBL13240777 0.77 GRIN2B (0.65) MEN1KMT2AKDM4EALDH1A1POLB

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
US-20090239873-A1 Phenyl-piperazine derivatives as modulators of muscarinic receptors BLANCO MIGUEL GARCIA-GUZMAN 2009-09-24 US disclosed
US-20090239873-A1 Phenyl-piperazine derivatives as modulators of muscarinic receptors BLANCO MIGUEL GARCIA-GUZMAN 2009-09-24 US disclosed
US-7563795-B2 Phenyl-piperazine derivatives as modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-07-21 US disclosed
US-7563795-B2 Phenyl-piperazine derivatives as modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-07-21 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-20090239873-A1 Phenyl-piperazine derivatives as modulators of muscarinic receptors CHRM3, CHRM5, CHRM2 MEN1 3939/4885KMT2A 1668/4885GLA 4397/4885

“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.