SCHEMBL9107842

SCHEMBL9107842

Nc1c2c(nc3cc(Cl)ccc13)C1CCC2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACHE P22303 16/20 1.00
BCHE P06276 10/20 0.65
NOS1 P29475 2/20 0.50
EPHX2 P34913 2/20 0.50
CHRM1 P11229 1/20 0.47

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
SCHEMBL9106878 0.91 ACHE (0.84) ACHEBCHENOS1EPHX2CHRM1
SCHEMBL9584001 0.89 ACHE (1.00) ACHEBCHENOS1EPHX2
SCHEMBL9107496 0.83 ACHE (0.71) ACHEBCHENOS1EPHX2
SCHEMBL9104297 0.83 ACHE (0.71) ACHEBCHE
SCHEMBL9106773 0.80 ACHE (0.66) ACHEBCHE
SCHEMBL9105019 0.80 ACHE (0.66) ACHEBCHENOS1CHRM1
SCHEMBL9106523 0.79 ACHE (1.00) ACHEBCHECHRM1
Hydrochloric Acid SCHEMBL10656143 0.78 ACHE (0.97) ACHEBCHECHRM1
SCHEMBL9108831 0.76 ACHE (0.60) ACHEBCHE
SCHEMBL9583069 0.75 ACHE (0.67) ACHEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4897400-A ENHANCING MEMORY HOESCHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1990-01-30 US claimed
US-8629157-B2 Pyrrolidine compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-14 US disclosed
US-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 US disclosed
US-5401749-A Memory enhancers, cholinergic agents HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-03-28 US disclosed
US-4897400-A ENHANCING MEMORY HOESCHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1990-01-30 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-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 ACHE 1832/4885BCHE 3324/4885NOS1 3912/4885

“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.