SCHEMBL7123385

SCHEMBL7123385

N#Cc1cnc(Oc2ccc(C(=O)N[C@@H]3C[C@H]4CC[C@@H]3N4)cc2)o1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.36
EPHX2 P34913 1/20 0.35
FAAH O00519 3/20 0.35
MMP2 P08253 1/20 0.34
MMP7 P09237 1/20 0.34
MMP9 P14780 1/20 0.34
MMP13 P45452 1/20 0.34
EGLN1 Q9GZT9 4/20 0.34
USP30 Q70CQ3 2/20 0.34
NAAA Q02083 2/20 0.33
EZH2 Q15910 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
CES1 P23141 1/20 0.33
NCEH1 Q6PIU2 1/20 0.33
KDM1A O60341 1/20 0.33

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
SCHEMBL7117119 0.86 NAAA (0.39) MMP2MMP7MMP9MMP13NAAA
SCHEMBL7127646 0.85 MMP13 (0.36) MMP2MMP7MMP9MMP13NAAA
SCHEMBL7125350 0.85 MMP2 (0.36) MMP2MMP7MMP9MMP13NAAA
SCHEMBL7122456 0.84 EPHX2 (0.35) PTGDR2EPHX2MMP2MMP7MMP9
SCHEMBL7120665 0.84 MMP2 (0.35) MMP2MMP7MMP9MMP13NAAA
SCHEMBL7125228 0.84 SCN9A (0.38) FAAHMMP2MMP7MMP9MMP13
SCHEMBL7124906 0.83 PTGDR2 (0.39) PTGDR2EPHX2MMP2MMP7MMP9
SCHEMBL7126982 0.83 PTGDR2 (0.39) PTGDR2EPHX2MMP2MMP7MMP9
SCHEMBL7124911 0.83 PTGDR2 (0.39) PTGDR2EPHX2MMP2MMP7MMP9
SCHEMBL7114474 0.83 EPHX2 (0.35) PTGDR2EPHX2MMP2MMP7MMP9

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-20030069296-A1 Substituted-aryl 7-aza[2.2.1]bicycloheptanes for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-04-10 US claimed
US-20030069296-A1 Substituted-aryl 7-aza[2.2.1]bicycloheptanes for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-04-10 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-20030069296-A1 Substituted-aryl 7-aza[2.2.1]bicycloheptanes for the treatment of disease CYP7B1, UGT2B7, CYP1B1 PTGDR2 559/4885EPHX2 194/4885FAAH 3511/4885

“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.