SCHEMBL9926038

SCHEMBL9926038

NCCN(CCNC(c1ccccc1)(c1ccccc1)c1ccccc1)CCNC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.67
KCNN4 O15554 2/20 0.46
DUT P33316 2/20 0.35
TAAR1 Q96RJ0 1/20 0.34
CARM1 Q86X55 1/20 0.34
PRMT6 Q96LA8 1/20 0.34
PRMT8 Q9NR22 1/20 0.34

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
SCHEMBL12264129 0.91 KIF11 (0.61) KIF11KCNN4DUT
SCHEMBL22919848 0.85 KIF11 (0.55) KIF11KCNN4DUT
SCHEMBL1105545 0.81 KIF11 (1.00) KIF11KCNN4DUTTAAR1
SCHEMBL28742617 0.80 KCNN4 (0.57) KIF11KCNN4
Bromide SCHEMBL5339582 0.79 KIF11 (0.96) KIF11KCNN4DUTTAAR1
SCHEMBL12264131 0.76 KIF11 (0.74) KIF11KCNN4DUTTAAR1
SCHEMBL2283152 0.76 KIF11 (0.74) KIF11KCNN4DUT
SCHEMBL9617559 0.74 KIF11 (0.78) KIF11KCNN4DUTTAAR1
SCHEMBL15160759 0.74 KIF11 (0.71) KIF11KCNN4DUT
SCHEMBL9654002 0.73 KIF11 (0.46) KIF11KCNN4DUT

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-20120149653-A1 MULTIFUNCTIONAL LINKERS AND METHODS FOR THE USE THEREOF RGO BIOSCIENCE LLC 2012-06-14 US disclosed
US-20120149732-A1 MULTIFUNCTIONAL LINKERS AND METHODS FOR THE USE THEREOF RGO BIOSCIENCE LLC 2012-06-14 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 (2 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-20120149732-A1 MULTIFUNCTIONAL LINKERS AND METHODS FOR THE USE THEREOF ILK, PAICS, THEM6 KIF11 3247/4885KCNN4 4751/4885DUT 404/4885
US-20120149653-A1 MULTIFUNCTIONAL LINKERS AND METHODS FOR THE USE THEREOF ILK, PAICS, THEM6 KIF11 3247/4885KCNN4 4751/4885DUT 404/4885

“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.