SCHEMBL6303192

SCHEMBL6303192

O=C(N[C@@H]1C[C@@H]2CCN(C2)C1)c1ccc(Oc2cccc(Cl)n2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 8/20 0.62
USP30 Q70CQ3 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GRM5 P41594 1/20 0.39
GPR119 Q8TDV5 1/20 0.39
F2 P00734 3/20 0.38
F10 P00742 3/20 0.38
ST14 Q9Y5Y6 3/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
HTR3E A5X5Y0 1/20 0.38
HTR3B O95264 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
HTR3A P46098 1/20 0.38
HTR3D Q70Z44 1/20 0.38
HTR3C Q8WXA8 1/20 0.38
BTK Q06187 1/20 0.37
HPGDS O60760 1/20 0.37

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
SCHEMBL6303191 1.00 CHRNA7 (0.62) CHRNA7USP30L3MBTL1GRM5GPR119
SCHEMBL6304507 0.95 CHRNA7 (0.55) CHRNA7USP30L3MBTL1GRM5GPR119
SCHEMBL6303396 0.83 CHRNA7 (0.86) CHRNA7USP30HTR3EHTR3BALOX15
SCHEMBL6303394 0.83 CHRNA7 (0.86) CHRNA7USP30HTR3EHTR3BALOX15
SCHEMBL6311325 0.83 CHRNA7 (0.54) CHRNA7L3MBTL1HTR3EHTR3BALOX15
SCHEMBL6303153 0.82 CHRNA7 (0.66) CHRNA7USP30ST14HTR3EHTR3B
SCHEMBL6303155 0.82 CHRNA7 (0.66) CHRNA7USP30ST14HTR3EHTR3B
SCHEMBL6311955 0.82 CHRNA7 (0.69) CHRNA7HTR3EHTR3BALOX15TSHR
SCHEMBL6311947 0.82 CHRNA7 (0.69) CHRNA7HTR3EHTR3BALOX15TSHR
SCHEMBL6303120 0.82 CHRNA7 (0.67) CHRNA7USP30

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6852716-B2 Substituted-aryl compounds for treatment of disease PFIZER INC (US) 2005-02-08 US claimed
US-20030236279-A1 Substituted-aryl compounds for treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 US claimed
US-6852716-B2 Substituted-aryl compounds for treatment of disease PFIZER INC (US) 2005-02-08 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-20030236279-A1 Substituted-aryl compounds for treatment of disease NAT1, CYP7A1, CYP7B1 CHRNA7 2937/4885USP30 4046/4885L3MBTL1 2491/4885

“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.