SCHEMBL7124160

SCHEMBL7124160

O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2)c1ccc(Sc2ccc(Cl)[nH]2)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.37
TRPV1 Q8NER1 1/20 0.34
SLC6A3 Q01959 5/20 0.34
SLC6A4 P31645 4/20 0.34
SLC6A2 P23975 2/20 0.34
HTR3E A5X5Y0 1/20 0.33
HTR3B O95264 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
HTR3A P46098 1/20 0.33
HTR3D Q70Z44 1/20 0.33
HTR3C Q8WXA8 1/20 0.33
EZH2 Q15910 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33
GRM5 P41594 3/20 0.32
F10 P00742 2/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL7125262 0.87 CHRNA7 (0.37) CHRNA7SLC6A3SLC6A4SLC6A2HTR3E
SCHEMBL7116402 0.85 CHRNA7 (0.35) CHRNA7TRPV1SLC6A3SLC6A4SLC6A2
SCHEMBL7123508 0.85 TRPV1 (0.44) CHRNA7TRPV1SLC6A3SLC6A4HTR3E
SCHEMBL7116441 0.85 CHRNA7 (0.36) CHRNA7SLC6A3SLC6A4SLC6A2HTR3E
SCHEMBL7123243 0.84 SLC6A4 (0.39) CHRNA7SLC6A3SLC6A4SLC6A2HTR3E
SCHEMBL7121734 0.84 CCR2 (0.36) CHRNA7SLC6A3SLC6A4SLC6A2TAS1R3
SCHEMBL7118012 0.84 EPHX2 (0.39) CHRNA7SLC6A3SLC6A4SLC6A2HTR3E
SCHEMBL7115048 0.84 CHRNA7 (0.35) CHRNA7TRPV1SLC6A3SLC6A4SLC6A2
SCHEMBL7127524 0.82 CHRNA7 (0.55) CHRNA7HTR3EHTR3BHTR3AHTR3D
SCHEMBL7124385 0.82 CHRNA7 (0.44) CHRNA7SLC6A3SLC6A4SLC6A2HTR3E

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 397/4885TRPV1 4850/4885SLC6A3 2265/4885

“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.