SCHEMBL21669646

SCHEMBL21669646

CCc1c(OC(F)(F)F)ccnc1OC

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
RUNX1 Q01196 1/20 0.33
CRHR1 P34998 3/20 0.33
NOS3 P29474 1/20 0.32
NOS2 P35228 1/20 0.32
LRRK2 Q5S007 2/20 0.32
SSTR1 P30872 6/20 0.31
SSTR4 P31391 6/20 0.31
ACSS2 Q9NR19 1/20 0.31
EGFR P00533 1/20 0.31
FGFR1 P11362 1/20 0.31
HRH4 Q9H3N8 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
SCHEMBL23743913 0.83 HPGD (0.43) HPGDSMN1; SMN2NOS3NOS2
SCHEMBL4082143 0.78 RUNX1 (0.35) HPGDSMN1; SMN2RUNX1LRRK2EGFR
SCHEMBL14853181 0.75 NOS2 (0.55) HPGDSMN1; SMN2NOS3NOS2LRRK2
SCHEMBL4077989 0.72 HPGD (0.49) HPGDSMN1; SMN2LRRK2SSTR1SSTR4
SCHEMBL21669647 0.72 HRH4 (0.33) RUNX1LRRK2HRH4
SCHEMBL4072811 0.71 ALDH1A1 (0.38) RUNX1
SCHEMBL18935479 0.71 F2R (0.38)
SCHEMBL4077988 0.71 HPGD (0.47) HPGDSMN1; SMN2LRRK2SSTR1SSTR4
SCHEMBL5208254 0.70 DRD1 (0.37) HPGDSMN1; SMN2RUNX1SSTR1SSTR4
SCHEMBL4072808 0.70 RUNX1 (0.37) SMN1; SMN2RUNX1

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-20200039943-A1 COMPOUNDS, DEVICES, AND USES THEREOF SIGILON THERAPEUTICS, INC. 2020-02-06 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-20200039943-A1 COMPOUNDS, DEVICES, AND USES THEREOF SLC10A1, SLCO1B3, SLC5A1 HPGD 350/4885SMN1; SMN2 1100/4885RUNX1 798/4885

“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.