SCHEMBL7123960

SCHEMBL7123960

Cc1coc(Sc2ccc(C(=O)N[C@@H]3C[C@H]4CC[C@@H]3N4)cc2)c1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.35
SLC6A4 P31645 6/20 0.34
SLC6A2 P23975 5/20 0.34
SLC6A3 Q01959 5/20 0.34
EZH2 Q15910 1/20 0.34
NPC1 O15118 1/20 0.33
CYP1A2 P05177 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
TAS1R2 Q8TE23 1/20 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
SCHEMBL7121747 0.89 CHRNA7 (0.35) CHRNA7SLC6A4SLC6A2SLC6A3EZH2
SCHEMBL7116310 0.88 CHRNA7 (0.35) CHRNA7SLC6A4SLC6A2SLC6A3EZH2
SCHEMBL7120607 0.87 SLC6A2 (0.37) CHRNA7SLC6A4SLC6A2SLC6A3
SCHEMBL7114485 0.86 CHRNA7 (0.35) CHRNA7SLC6A4SLC6A2SLC6A3EZH2
SCHEMBL7121884 0.85 EPHX2 (0.40) CHRNA7SLC6A4SLC6A2SLC6A3NPC1
SCHEMBL7120625 0.85 CCR2 (0.36) CHRNA7TAS1R3TAS1R1TAS1R2
SCHEMBL7116865 0.83 CHRNA7 (0.36) CHRNA7SLC6A4SLC6A2SLC6A3EZH2
SCHEMBL7124928 0.83 CHRNA7 (0.40) CHRNA7SLC6A4SLC6A2SLC6A3EZH2
SCHEMBL7122345 0.82 USP30 (0.38) CHRNA7NPC1RAB9A
SCHEMBL7115016 0.81 CHRNA7 (0.35) CHRNA7SLC6A4SLC6A2SLC6A3EZH2

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 CHRNA7 397/4885SLC6A4 2137/4885SLC6A2 1156/4885

“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.