SCHEMBL1179599

SCHEMBL1179599

CNCC1CCCN(C2CN(C)C2)C1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
CCR3 P51677 2/20 0.34
BCHE P06276 2/20 0.33
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
ROCK2 O75116 1/20 0.32
ROCK1 Q13464 1/20 0.32
CDC42BPB Q9Y5S2 1/20 0.32
LSS P48449 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
RPS6KB1 P23443 1/20 0.31
AKT1 P31749 1/20 0.31
CCR2 P41597 3/20 0.30
KDM1A O60341 1/20 0.30
KCNH2 Q12809 1/20 0.30
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL2885366 0.81 CHRM2 (0.38) CARM1PRMT6ROCK2ROCK1CDC42BPB
SCHEMBL19575592 0.81 CHRM2 (0.38) CARM1PRMT6ROCK2ROCK1CDC42BPB
SCHEMBL13874675 0.77 DPP4 (0.38) L3MBTL1SIGMAR1
SCHEMBL13874672 0.77 DPP4 (0.38) L3MBTL1SIGMAR1
SCHEMBL13325440 0.73
SCHEMBL90794 0.73
SCHEMBL4328940 0.73
Hydrochloric Acid SCHEMBL31505915 0.71 NCF1 (0.43) CARM1PRMT6L3MBTL1KDM1A
SCHEMBL24196665 0.71 RPS6KB1 (0.36) CARM1PRMT6ROCK2ROCK1CDC42BPB
SCHEMBL23943527 0.70 USP1 (0.32) L3MBTL1

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
EP-2240458-B1 ARYL SULFONAMIDES AS EFFECTIVE ANALGESICS BOEHRINGER INGELHEIM INT (DE) 2011-08-03 EP disclosed
US-20110046106-A1 ARYL SULFONAMIDES AS EFFECTIVE ANALGESICS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-02-24 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-20110046106-A1 ARYL SULFONAMIDES AS EFFECTIVE ANALGESICS SULT2A1, SULT1A1, ARSA ALDH1A1 60/4885CCR3 1063/4885BCHE 1828/4885

“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.