SCHEMBL3587663

SCHEMBL3587663

CCOC(=O)c1c(C(O)(C(=O)OCC)C(F)(F)F)c2cc(OC)ccc2n1Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 15/20 0.52
PLA2G1B P04054 1/20 0.52
KMT2A Q03164 2/20 0.46
ELANE P08246 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL3601368 0.84 MAPT (0.45) KMT2AELANE
SCHEMBL13254021 0.79 PLA2G2A (0.54) PLA2G2APLA2G1BTSHR
SCHEMBL31219110 0.73 PLA2G2A (0.52) PLA2G2APLA2G1BKMT2ATSHRMAPK1
SCHEMBL3587646 0.72 ALDH1A1 (0.46) KMT2AELANETSHRMAPK1
SCHEMBL7962081 0.72 PLA2G2A (0.80) PLA2G2APLA2G1BKMT2ATSHRMAPK1
SCHEMBL6856097 0.71 PLA2G2A (0.63) PLA2G2APLA2G1BKMT2ATSHRMAPK1
SCHEMBL3605317 0.71 ALDH1A1 (0.63) KMT2ATSHR
SCHEMBL9538311 0.70 CCR2 (0.60) PLA2G2APLA2G1BKMT2ATSHRMAPK1
SCHEMBL1504118 0.70 MAPT (0.55) KMT2ATSHR
SCHEMBL9622481 0.70 NOD2 (0.64) PLA2G2APLA2G1BKMT2ATSHR

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 2 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
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 PLA2G2A 3533/4885PLA2G1B 3473/4885KMT2A 4721/4885

“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.