SCHEMBL3597954

SCHEMBL3597954

CCOC(=O)C(O)(c1cn(C)c2cc(NS(C)(=O)=O)ccc12)C(F)(F)F

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.50
PGR P06401 2/20 0.41
HPGD P15428 1/20 0.40
RECQL P46063 1/20 0.40
KAT2B Q92831 1/20 0.40
MAPK1 P28482 3/20 0.40
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MMP2 P08253 1/20 0.39
MMP13 P45452 1/20 0.39
NR3C1 P04150 1/20 0.38
NR3C2 P08235 1/20 0.38
AR P10275 1/20 0.38
GAA P10253 1/20 0.37

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
SCHEMBL3589822 0.89 MAPT (0.47) GLARECQLMAPK1MAPTNPSR1
SCHEMBL3598788 0.84 P2RX3 (0.43) GLAPGRMAPK1MAPTNPSR1
SCHEMBL3590965 0.82 GLA (0.54) GLAMAPK1MAPTNPSR1
SCHEMBL13254019 0.78 GLA (0.75) GLAHPGDMAPK1NPSR1
SCHEMBL3591270 0.78 GLA (0.47) GLAPGRMAPK1MAPTNPSR1
SCHEMBL3599490 0.78 GLA (0.49) GLAMAPK1MAPT
SCHEMBL3597020 0.74 GLA (0.51) GLAMAPK1AR
SCHEMBL3604598 0.74 MAPT (0.43) RECQLMAPTARGAA
SCHEMBL3597532 0.71 LMNA (0.46) GLAHPGDRECQLMAPTNPSR1
SCHEMBL3592376 0.70 MAPT (0.46) MAPTGAA

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
US-20100190768-A1 NOVEL FUSED PYROLE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-07-29 US disclosed
US-20100190768-A1 NOVEL FUSED PYROLE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-07-29 US disclosed
US-20100190768-A1 NOVEL FUSED PYROLE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-07-29 US disclosed
EP-1930320-A1 NOVEL FUSED PYRROLE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2008-06-11 EP 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-20100190768-A1 NOVEL FUSED PYROLE DERIVATIVE NR3C1, NR3C2, NR0B1 GLA 3982/4885PGR 325/4885HPGD 3544/4885

“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.