SCHEMBL4254347

SCHEMBL4254347

[O]C1CCCCCCCCCCCCC1=S

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.36
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
MAPT P10636 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TRIM24 O15164 1/20 0.30
TRIM33 Q9UPN9 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
SCHEMBL4265270 1.00
SCHEMBL4257324 1.00 KMT2A (0.36) KMT2ACA1CA2CA4MAPT
SCHEMBL4262601 1.00 KMT2A (0.36) KMT2ACA1CA2CA4MAPT
SCHEMBL4261755 1.00 KMT2A (0.36) KMT2ACA1CA2CA4MAPT
SCHEMBL4258055 1.00 KMT2A (0.36) KMT2ACA1CA2CA4MAPT
SCHEMBL4261584 1.00 KMT2A (0.36) KMT2ACA1CA2CA4MAPT
SCHEMBL4265264 1.00 KMT2A (0.36) KMT2ACA1CA2CA4MAPT
SCHEMBL4254125 1.00 KMT2A (0.36) KMT2ACA1CA2CA4MAPT
SCHEMBL4260877 1.00 KMT2A (0.36) KMT2ACA1CA2CA4MAPT
SCHEMBL4258815 1.00 KMT2A (0.36) KMT2ACA1CA2CA4MAPT

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-8084625-B2 Crosslinking agent, crosslinking method, method of controlling gene expression, and method of examining gene function WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2011-12-27 US disclosed
US-20090023140-A1 CROSSLINKING AGENT, CROSSLINKING METHOD, METHOD OF CONTROLLING GENE EXPRESSION, AND METHOD OF EXAMINING GENE FUNCTION WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2009-01-22 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-20090023140-A1 CROSSLINKING AGENT, CROSSLINKING METHOD, METHOD OF CONTROLLING GENE EXPRESSION, AND METHOD OF EXAMINING GENE FUNCTION DCLRE1A, RNGTT, NSUN2 KMT2A 1462/4885CA1 3648/4885CA2 4281/4885

“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.