SCHEMBL1045372

SCHEMBL1045372

CCN1CCCN(CC)CCN(CC)CCC1

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
CYP2D6 P10635 1/20 0.46
CHRNA7 P36544 1/20 0.42
HSD11B1 P28845 1/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
RAD52 P43351 1/20 0.39
GFER P55789 1/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL577863 1.00 KMT2A (0.46) KMT2ACYP2D6CHRNA7HSD11B1ALDH1A1
SCHEMBL577083 1.00 KMT2A (0.46) KMT2ACYP2D6CHRNA7HSD11B1ALDH1A1
SCHEMBL19679817 1.00 KMT2A (0.46) KMT2ACYP2D6CHRNA7HSD11B1ALDH1A1
SCHEMBL19679818 1.00 KMT2A (0.46) KMT2ACYP2D6CHRNA7HSD11B1ALDH1A1
SCHEMBL19679814 1.00 KMT2A (0.46) KMT2ACYP2D6CHRNA7HSD11B1ALDH1A1
SCHEMBL2759514 1.00 KMT2A (0.46) KMT2ACYP2D6CHRNA7HSD11B1ALDH1A1
SCHEMBL1044668 1.00 KMT2A (0.46) KMT2ACYP2D6CHRNA7HSD11B1ALDH1A1
SCHEMBL48580 0.96
SCHEMBL1093603 0.96
SCHEMBL1043052 0.96 CYP2D6 (0.48) KMT2ACYP2D6CHRNA7HSD11B1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8017706-B2 Process for production of polymers with iron complex catalyst DIC CORPORATION (JP) 2011-09-13 US disclosed
US-20110105703-A1 PROCESS FOR PRODUCTION OF POLYMERS WITH IRON COMPLEX CATALYST DIC Corporatio (JP) 2011-05-05 US disclosed
EP-2269995-A1 PROCESS FOR PRODUCTION OF POLYMERS WITH IRON COMPLEX CATALYST DIC Corporation (JP) 2011-01-05 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-20110105703-A1 PROCESS FOR PRODUCTION OF POLYMERS WITH IRON COMPLEX CATALYST TFRC, FECH, FTH1 KMT2A 2515/4885CYP2D6 1882/4885CHRNA7 4595/4885

“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.