SCHEMBL6651568

SCHEMBL6651568

CC(=O)Oc1c(C(=O)OC2CC2)c2c(c3ccccc13)OC(c1ccccc1)(c1ccccc1)C=C2

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TP53 P04637 1/20 0.33
GAA P10253 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP3A4 P08684 1/20 0.31
PTPN1 P18031 1/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
SCN1A P35498 1/20 0.31
SCN2A Q99250 1/20 0.31
SCN3A Q9NY46 1/20 0.31
HTR3A P46098 2/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL8978531 0.87 SMN1; SMN2 (0.36) HTTMAPTKDM4ETP53GAA
SCHEMBL6650625 0.83 MEN1 (0.35) HTTMAPTKDM4EHSD17B10POLB
SCHEMBL6651346 0.81 L3MBTL1 (0.36) MAPTKDM4ETP53HSD17B10POLB
SCHEMBL10102407 0.81 KDM4E (0.33) HTTMAPTKDM4ETP53GAA
SCHEMBL12952422 0.80 CYP3A4 (0.30) CYP3A4
SCHEMBL5157934 0.80 GABRA1 (0.33) HTTMAPTKDM4EGAAHSD17B10
SCHEMBL15254539 0.79 KDM4E (0.39) HTTMAPTKDM4ETP53TSHR
SCHEMBL17929223 0.78 KDM4E (0.39) MAPTKDM4ETP53HSD17B10POLB
SCHEMBL5158212 0.78 MAPT (0.43) HTTMAPTKDM4ETP53GAA
SCHEMBL5159928 0.78 NCEH1 (0.32) HTTMAPTKDM4ETP53GAA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1248778-B1 SUBSTITUTED PHOTOCHROMIC 2H-NAPHTHO 1,2-B] PYRAN COMPOUNDS PPG IND OHIO INC (US) 2004-06-16 EP claimed
US-6340766-B1 PHOTOCHROMIC DYES ON SUBSTRATES LIKE GLASS WITH PROTECTIVE COATINGS TRANSITION OPTICAL, INC. 2002-01-22 US claimed
US-20020007078-A1 Novel substituted naphthopyrans TRANSITIONS OPTICAL LIMITED (IE) 2002-01-17 US claimed
EP-1248778-B1 SUBSTITUTED PHOTOCHROMIC 2H-NAPHTHO 1,2-B] PYRAN COMPOUNDS PPG IND OHIO INC (US) 2004-06-16 EP disclosed
US-6340766-B1 PHOTOCHROMIC DYES ON SUBSTRATES LIKE GLASS WITH PROTECTIVE COATINGS TRANSITION OPTICAL, INC. 2002-01-22 US disclosed
US-20020007078-A1 Novel substituted naphthopyrans TRANSITIONS OPTICAL LIMITED (IE) 2002-01-17 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-20020007078-A1 Novel substituted naphthopyrans CRYZ, NR2E3, UACA HTT 2179/4885MAPT 1279/4885KDM4E 1437/4885

“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.