SCHEMBL7123432

SCHEMBL7123432

N#Cc1ccc(Oc2ccc(C(=O)N[C@@H]3C[C@H]4CC[C@@H]3N4)cc2)cn1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.39
MMP7 P09237 1/20 0.39
MMP9 P14780 1/20 0.39
MMP13 P45452 1/20 0.39
USP30 Q70CQ3 2/20 0.38
EGLN1 Q9GZT9 2/20 0.37
P2RX3 P56373 1/20 0.37
NAAA Q02083 1/20 0.37
EPHX2 P34913 1/20 0.37
ST14 Q9Y5Y6 1/20 0.37
FAAH O00519 1/20 0.37
CTSC P53634 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
EZH2 Q15910 1/20 0.35
SCN9A Q15858 5/20 0.35

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
SCHEMBL7120572 0.87 EPHX2 (0.49) MMP2MMP7MMP9MMP13USP30
SCHEMBL7121872 0.86 KCNQ3 (0.46) MMP2MMP7MMP9MMP13NAAA
SCHEMBL7116799 0.86 KDR (0.39) MMP2MMP7MMP9MMP13USP30
SCHEMBL7117995 0.85 MMP2 (0.40) MMP2MMP7MMP9MMP13NAAA
SCHEMBL7115237 0.85 CHRNA7 (0.37) EGLN1EPHX2CTSCNPC1RAB9A
SCHEMBL7125176 0.84 HRH3 (0.42) MMP2MMP7MMP9MMP13NAAA
SCHEMBL7116059 0.84 POLB (0.39) MMP2MMP7MMP9MMP13NAAA
SCHEMBL7116341 0.83 EPHX2 (0.35) MMP2MMP7MMP9MMP13USP30
SCHEMBL7125203 0.83 EPHX2 (0.40) MMP2MMP7MMP9MMP13USP30
SCHEMBL7122587 0.83 ACACB (0.41) MMP2MMP7MMP9MMP13EPHX2

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 MMP2 3731/4885MMP7 2061/4885MMP9 3029/4885

“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.