SCHEMBL25852259

SCHEMBL25852259

CCC1(CC)O[C@@H](c2ccc3c(N)ncnn23)[C@H](OCc2ccccc2)[C@@H]1C

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.36
▸ TNK2 Q07912 2/20 0.32
▸ RIPK1 Q13546 3/20 0.32
▸ DOT1L Q8TEK3 1/20 0.32
▸ DHFR P00374 1/20 0.30
▸ RET P07949 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
SCHEMBL16708502 0.90 POLRMT (0.35) POLRMTTNK2RIPK1DOT1LDHFR
SCHEMBL18371669 0.90 POLRMT (0.35) POLRMTTNK2RIPK1DOT1LDHFR
SCHEMBL16708521 0.87 POLRMT (0.34) POLRMTTNK2RIPK1DOT1LRET
SCHEMBL18371672 0.87 POLRMT (0.34) POLRMTTNK2RIPK1DOT1LRET
SCHEMBL25852194 0.86 DHFR (0.31) DHFR
SCHEMBL25852191 0.86 DHFR (0.31) DHFR
SCHEMBL25300989 0.83 POLRMT (0.38) POLRMTTNK2RIPK1DOT1L
SCHEMBL25853155 0.83 POLRMT (0.38) POLRMTTNK2RIPK1DOT1L
SCHEMBL25254465 0.83 POLRMT (0.38) POLRMTTNK2RIPK1DOT1L
SCHEMBL16708471 0.80 POLRMT (0.33) POLRMTTNK2RIPK1DOT1LRET

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-11697666-B2 Methods of preparing carbanucleosides using amides GILEAD SCIENCES, INC. (US) 2023-07-11 — — 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-11697666-B2 Methods of preparing carbanucleosides using amides NCL, DUT, POLN POLRMT 89/4885TNK2 732/4885RIPK1 3841/4885

“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