SCHEMBL3314859

SCHEMBL3314859

CS(=O)(=O)Nc1ccc(Oc2ccc(F)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.71
FFAR1 O14842 1/20 0.59
FFAR4 Q5NUL3 1/20 0.59
SCN9A Q15858 2/20 0.55
KIF11 P52732 1/20 0.54
PTPN1 P18031 1/20 0.53
LMNA P02545 2/20 0.51
GAA P10253 1/20 0.51
MAPK1 P28482 1/20 0.51
MMP2 P08253 2/20 0.51
MMP3 P08254 1/20 0.51
MMP9 P14780 1/20 0.51
MMP14 P50281 1/20 0.51
LTA4H P09960 1/20 0.51
MMP1 P03956 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SOS1 Q07889 1/20 0.50
CACNA1H O95180 1/20 0.50
CACNA1B Q00975 1/20 0.50

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
SCHEMBL4205144 0.90 PGR (0.85) PGRFFAR1KIF11PTPN1LMNA
SCHEMBL644458 0.88 KEAP1 (0.60) PGRKIF11LMNAMAPK1NR3C2
SCHEMBL3116450 0.83 PGR (0.73) PGRKIF11LMNAGAAMAPK1
SCHEMBL28015271 0.83 PGR (1.00) PGRFFAR1FFAR4GAANPC1
SCHEMBL3112491 0.83 PGR (0.73) PGRFFAR1KIF11PTPN1LMNA
SCHEMBL4659812 0.82 KIF11 (0.66) KIF11LMNANR3C2HPGDSMN1; SMN2
SCHEMBL2451476 0.81 PGR (0.71) PGRFFAR1KIF11PTPN1LMNA
SCHEMBL3111013 0.81 KIF11 (0.73) PGRKIF11PTPN1LMNAGAA
SCHEMBL3107843 0.81 KIF11 (0.82) PGRKIF11PTPN1LMNAGAA
SCHEMBL3376915 0.79 PGR (0.90) PGRFFAR1FFAR4KIF11NPC1

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-20100105651-A1 ANTAGONISTS OF SNS SODIUM CHANNELS VERNALIS (R&D) LIMITED (GB) 2010-04-29 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-20100105651-A1 ANTAGONISTS OF SNS SODIUM CHANNELS CNR1, OPRL1, CHRNA10 PGR 730/4885FFAR1 380/4885FFAR4 820/4885

“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.