SCHEMBL23773045

SCHEMBL23773045

C[C@@H]1[C@@H](COCc2ccccc2)OC(=O)[C@@H]1C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
CTRB1 P17538 1/20 0.42
TSHR P16473 2/20 0.41
FASN P49327 1/20 0.41
NAAA Q02083 1/20 0.41
PTPN1 P18031 2/20 0.39
CDC25B P30305 1/20 0.39
AKT1 P31749 1/20 0.38
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
CYP3A4 P08684 3/20 0.37
MAPT P10636 1/20 0.37
CYP2C19 P33261 1/20 0.37
PLA2G6 O60733 2/20 0.37
PLA2G4A P47712 1/20 0.37
TACR2 P21452 1/20 0.36

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
SCHEMBL13449565 0.95 LMNA (0.46) LMNACTRB1TSHRFASNNAAA
SCHEMBL12781985 0.89 LMNA (0.43) LMNACTRB1TSHRFASNNAAA
SCHEMBL13449577 0.88 BCHE (0.45) LMNACTRB1NAAAPTPN1CDC25B
SCHEMBL16689647 0.83 BCHE (0.46) LMNACTRB1TSHRFASNNAAA
SCHEMBL17320856 0.83 BCHE (0.46) LMNAPTPN1CDC25BBCHEACHE
SCHEMBL21243992 0.81 BCHE (0.50) LMNACTRB1NAAAPTPN1CDC25B
SCHEMBL18521909 0.81 BCHE (0.50) LMNACTRB1NAAAPTPN1CDC25B
SCHEMBL10177102 0.81 BCHE (0.50) LMNACTRB1NAAAPTPN1CDC25B
SCHEMBL10328076 0.81 BCHE (0.50) LMNACTRB1NAAAPTPN1CDC25B
SCHEMBL12264790 0.79 CTRB1 (0.51) CTRB1FASNPLA2G6PLA2G4A

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-20210253622-A1 2'- SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. 2021-08-19 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-20210253622-A1 2'- SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, SLC29A1, RNMT LMNA 1609/4885CTRB1 2104/4885TSHR 3632/4885

“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.