SCHEMBL3583780

SCHEMBL3583780

CCOC(=O)C(O)(c1cn(Cc2ccccc2)c2ccc(C(=O)O)cc12)C(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 1/20 0.47
PTPN1 P18031 1/20 0.46
TP53 P04637 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
GLA P06280 1/20 0.40
SERPINE1 P05121 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
POLB P06746 1/20 0.39
PLA2G2A P14555 2/20 0.39
PLA2G4A P47712 1/20 0.39
MAPK1 P28482 2/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL3598494 0.92 F2RL3 (0.45) F2RL3PTPN1TP53GLASERPINE1
SCHEMBL3598928 0.91 F2RL3 (0.48) F2RL3PTPN1TP53ALDH1A1LMNA
SCHEMBL3591579 0.88 PTPN1 (0.46) F2RL3PTPN1GLASERPINE1L3MBTL1
SCHEMBL3592319 0.88 GLA (0.52) F2RL3PTPN1TP53ALDH1A1LMNA
SCHEMBL13254021 0.87 PLA2G2A (0.54) PTPN1ALDH1A1LMNASERPINE1PLA2G2A
SCHEMBL3585213 0.85 PLA2G2A (0.44) F2RL3PTPN1ALDH1A1LMNAPLA2G2A
SCHEMBL3600671 0.83 PTPN1 (0.47) F2RL3PTPN1ALDH1A1LMNAGLA
SCHEMBL3600338 0.83 GLA (0.43) F2RL3PTPN1ALDH1A1GLASERPINE1
SCHEMBL3597849 0.83 F2RL3 (0.46) F2RL3PTPN1TP53LMNAGLA
SCHEMBL3602094 0.82 GLA (0.42) F2RL3PTPN1GLASERPINE1L3MBTL1

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 5 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
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 F2RL3 555/4885PTPN1 752/4885TP53 3579/4885

“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.