SCHEMBL13696400

SCHEMBL13696400

CCCCOCC1C[C@H](C)[C@H](c2ccc3c(N)ncnn23)O1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DOT1L Q8TEK3 2/20 0.35
▸ POLRMT O00411 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ USP2 O75604 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31

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
SCHEMBL9912317 1.00 DOT1L (0.35) DOT1LPOLRMTSMN1; SMN2USP2ALDH1A1
SCHEMBL13532238 0.88 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL18666890 0.84 HSPA5 (0.36) DOT1LPOLRMT
SCHEMBL9912314 0.83 PIK3CD (0.32) SMN1; SMN2
SCHEMBL15605849 0.81 DOT1L (0.34) DOT1LPOLRMT
SCHEMBL13696066 0.81 DOT1L (0.37) DOT1LPOLRMT
SCHEMBL13532219 0.81 DOT1L (0.37) DOT1LPOLRMT
SCHEMBL20058766 0.81 DOT1L (0.37) DOT1LPOLRMT
SCHEMBL13532236 0.80 ALDH1A1 (0.33) SMN1; SMN2USP2ALDH1A1POLBALOX15
SCHEMBL10112577 0.80 DOT1L (0.36) DOT1LPOLRMTUSP2ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090227524-A1 ANTIVIRAL THERAPEUTIC AGENTS BIOCRYST PHARMACEUTICALS, INC. (US) 2009-09-10 — — 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-20090227524-A1 ANTIVIRAL THERAPEUTIC AGENTS EIF2AK2, ZC3HAV1, MAVS DOT1L 3413/4885POLRMT 32/4885SMN1; SMN2 2147/4885

“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.

Send feedback