SCHEMBL9548652

SCHEMBL9548652

Cc1cn([C@H]2CCC(CO)(CO)O2)c(=O)[nH]c1=O

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TK1 P04183 8/20 0.51
LMNA P02545 3/20 0.48
ALB P02768 2/20 0.48
BLM P54132 2/20 0.48
ALDH1A1 P00352 1/20 0.48
POLB P06746 1/20 0.48
ADRA1A P35348 1/20 0.48
TSHR P16473 2/20 0.47
PKM P14618 1/20 0.47
PMP22 Q01453 1/20 0.47
CYP2D6 P10635 1/20 0.47

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
SCHEMBL20833453 0.95 TK1 (0.47) TK1LMNAALBBLMALDH1A1
SCHEMBL20879499 0.93 TK1 (0.47) TK1LMNAALBBLMALDH1A1
SCHEMBL24695053 0.86 TK1 (0.50) TK1LMNAALBBLMALDH1A1
SCHEMBL23622010 0.85 TK1 (0.49) TK1LMNAALBBLMALDH1A1
SCHEMBL12060749 0.85 LMNA (0.53) TK1LMNAADRA1ATSHRPMP22
SCHEMBL9151712 0.83 TK1 (0.49) TK1LMNAALBBLMALDH1A1
SCHEMBL9151709 0.83 TK1 (0.49) TK1LMNAALBBLMALDH1A1
SCHEMBL20833146 0.82 TK1 (0.47) TK1LMNAALBBLMALDH1A1
SCHEMBL15184742 0.82 TK1 (0.50) TK1LMNAALBBLMALDH1A1
SCHEMBL10083240 0.82 TK1 (0.47) TK1LMNAALBBLMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023178133-A9 COMPOUNDS AND METHODS FOR TREATING DISEASE ROME THERAPEUTICS, INC. (US) 2023-10-26 WO disclosed
WO-2023178133-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE ROME THERAPEUTICS, INC. (US) 2023-09-21 WO disclosed
US-20120034184-A1 4'-SUBSTITUTED NUCLEOSIDE DERIVATIVES AS INHIBITORS OF HCV RNA REPLICATION DEVOS RENE ROBERT (GB) 2012-02-09 US disclosed
US-5192749-A Viricide, AIDS SYNTEX (U.S.A.) INC. (US) 1993-03-09 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-20120034184-A1 4'-SUBSTITUTED NUCLEOSIDE DERIVATIVES AS INHIBITORS OF HCV RNA REPLICATION NSUN2, RNGTT, RNMT TK1 533/4885LMNA 2119/4885ALB 1810/4885

“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.