SCHEMBL709202

SCHEMBL709202

COc1ccc(C=CC=Cc2ccccn2)cc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.49
PTGS2 P35354 1/20 0.49
KDM4E B2RXH2 3/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
MAPT P10636 3/20 0.45
MAPK1 P28482 2/20 0.45
GAA P10253 2/20 0.45
ALDH1A1 P00352 3/20 0.44
NFE2L2 Q16236 1/20 0.44
CYP1A1 P04798 2/20 0.43
CYP1A2 P05177 2/20 0.43
CYP1B1 Q16678 2/20 0.43
CYP19A1 P11511 1/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
APP P05067 3/20 0.43
TUBB1 Q9H4B7 4/20 0.42
GFER P55789 1/20 0.42

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
SCHEMBL709201 1.00 PTGS1 (0.49) PTGS1PTGS2KDM4ENPC1RAB9A
SCHEMBL709523 0.88 CYP1A1 (0.57) PTGS1PTGS2KDM4ENPC1RAB9A
SCHEMBL709522 0.88 CYP1A1 (0.57) PTGS1PTGS2KDM4ENPC1RAB9A
SCHEMBL708558 0.83 PTGS1 (0.55) PTGS1PTGS2KDM4ENPC1RAB9A
SCHEMBL708559 0.83 PTGS1 (0.55) PTGS1PTGS2KDM4ENPC1RAB9A
SCHEMBL708382 0.82 XDH (0.62) RAB9AMAPTGAANFE2L2APP
SCHEMBL708383 0.82 XDH (0.62) RAB9AMAPTGAANFE2L2APP
SCHEMBL711194 0.80 KDM4E (0.48) PTGS1PTGS2KDM4ENPC1RAB9A
SCHEMBL711195 0.80 KDM4E (0.48) PTGS1PTGS2KDM4ENPC1RAB9A
SCHEMBL710996 0.79 KRAS (0.58) KDM4ENPC1RAB9AMAPTMAPK1

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-8124625-B2 enhancing the expression of apoAI; prevention or therapy of dislipidemia SHIONOGI & CO., LTD. (JP) 2012-02-28 US disclosed
US-8053445-B2 Utilities of olefin derivatives SHIONOGI & CO., LTD. (JP) 2011-11-08 US disclosed
US-20090036457-A1 Utilities of olefin derivatives YAMAMORI TERUO 2009-02-05 US disclosed
US-20040242615-A1 Utilities of olefin derivatives SHIONOGI & CO., LTD. (JP) 2004-12-02 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 (2 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-20040242615-A1 Utilities of olefin derivatives APOL1, NR1H2, APOB PTGS1 1963/4885PTGS2 1985/4885KDM4E 4415/4885
US-20090036457-A1 Utilities of olefin derivatives APOL1, APOB, NR1H2 PTGS1 2192/4885PTGS2 2268/4885KDM4E 4647/4885

“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.