SCHEMBL7120695

SCHEMBL7120695

N#Cc1cccc(Sc2ccc(C(=O)N[C@@H]3C[C@H]4CC[C@@H]3N4)cc2)n1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.38
CHRNA7 P36544 1/20 0.36
CTSC P53634 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
EZH2 Q15910 1/20 0.32
GRM5 P41594 2/20 0.32
KDM1A O60341 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
SLC6A3 Q01959 2/20 0.31

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
SCHEMBL7116968 0.85 CHRNA7 (0.38) CHRNA7EZH2GRM5SLC6A2SLC6A4
SCHEMBL7125357 0.85 CHRNA7 (0.38) CHRNA7NPC1RAB9AEZH2GRM5
SCHEMBL7124694 0.83 CHRNA7 (0.36) CHRNA7EZH2GRM5SLC6A2SLC6A4
SCHEMBL7121241 0.83 EPHX2 (0.35) EPHX2CHRNA7NPC1RAB9AEZH2
SCHEMBL7123977 0.83 NPC1 (0.36) EPHX2CHRNA7NPC1RAB9AEZH2
SCHEMBL7123895 0.83 MGLL (0.38) CHRNA7EZH2ALDH1A1
SCHEMBL7115079 0.83 SLC6A4 (0.37) CHRNA7EZH2SLC6A2SLC6A4SLC6A3
SCHEMBL7125131 0.82 EPHX2 (0.49) EPHX2CHRNA7NPC1RAB9AEZH2
SCHEMBL7115237 0.82 CHRNA7 (0.37) EPHX2CHRNA7CTSCNPC1RAB9A
SCHEMBL7116049 0.82 CHRNA7 (0.35) CHRNA7NPC1RAB9AEZH2LMNA

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 EPHX2 194/4885CHRNA7 397/4885CTSC 1929/4885

“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.