SCHEMBL7124385

SCHEMBL7124385

O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2)c1ccc(Sc2ccc(O)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.44
EZH2 Q15910 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
GRM2 Q14416 1/20 0.36
GRM3 Q14832 1/20 0.36
CNR2 P34972 1/20 0.35
NR1H2 P55055 1/20 0.35
PRKCB P05771 2/20 0.34
PRKCA P17252 2/20 0.34
PRKCE Q02156 2/20 0.34
MGLL Q99685 1/20 0.34
PRKCG P05129 1/20 0.34
PRKCH P24723 1/20 0.34
PRKCZ Q05513 1/20 0.34
PRKCD Q05655 1/20 0.34
CHRNB4 P30926 1/20 0.34

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
SCHEMBL7127524 0.90 CHRNA7 (0.55) CHRNA7EZH2EPHX2HTR3EHTR3B
SCHEMBL7123508 0.89 TRPV1 (0.44) CHRNA7EZH2SLC6A4SLC6A3HTR3E
SCHEMBL7116048 0.89 HPGD (0.46) CHRNA7EZH2SLC6A2SLC6A4SLC6A3
SCHEMBL7125201 0.89 DDB1 (0.43) CHRNA7EZH2SLC6A2SLC6A4SLC6A3
SCHEMBL7124390 0.89 CHRNA7 (0.43) CHRNA7EZH2SLC6A2SLC6A4SLC6A3
SCHEMBL7121781 0.89 CHRNA7 (0.44) CHRNA7EZH2MGLLCHRNB4CHRNA3
SCHEMBL7125131 0.87 EPHX2 (0.49) CHRNA7EZH2SLC6A2SLC6A4SLC6A3
SCHEMBL7123966 0.86 GRM5 (0.43) CHRNA7SLC6A2SLC6A4SLC6A3GRM2
SCHEMBL7120658 0.85 MMP2 (0.45) EZH2OPRM1OPRD1GRM2GRM3
SCHEMBL7117116 0.85 CHRNA7 (0.42) CHRNA7EZH2SLC6A2SLC6A4SLC6A3

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 397/4885EZH2 462/4885OPRM1 1856/4885

“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.