SCHEMBL23765250

SCHEMBL23765250

CCCCCCCC(CCCCCCC)N1C[C@@H](F)[C@H](F)C1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FDPS P14324 4/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
DNM1 Q05193 2/20 0.34
EBP Q15125 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
OPRM1 P35372 1/20 0.33
TSHR P16473 1/20 0.33
GUSB P08236 1/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL22778569 0.87 GNAI3 (0.35) FDPSDNM1OPRM1TSHR
SCHEMBL24424826 0.87 GNAI3 (0.35) FDPSDNM1OPRM1TSHR
SCHEMBL22990204 0.87 GNAI3 (0.35) FDPSDNM1OPRM1TSHR
SCHEMBL23733443 0.81 EBP (0.38) FDPSLMNADNM1EBPSIGMAR1
SCHEMBL24555502 0.81 EBP (0.38) FDPSLMNADNM1EBPSIGMAR1
SCHEMBL23733438 0.81 EBP (0.38) FDPSLMNADNM1EBPSIGMAR1
SCHEMBL23733462 0.80 GNAI3 (0.38) FDPSLMNAMAPT
SCHEMBL22096780 0.79 GNAI3 (0.39)
SCHEMBL19780154 0.79 GNAI3 (0.39)
SCHEMBL19880406 0.79 GNAI3 (0.39)

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-20210253614-A1 COMPOSITIONS AND METHODS FOR INHIBITING CD73 PELOTON THERAPEUTICS, INC. (US) 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-20210253614-A1 COMPOSITIONS AND METHODS FOR INHIBITING CD73 ENTPD5, NT5E, ENTPD1 FDPS 1367/4885LMNA 773/4885MAPT 4367/4885

“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.