SCHEMBL2496243

SCHEMBL2496243

CC[C@H](NC(=O)[C@H]1C[C@@H]1c1ccccc1)c1ccc(-c2ccc(OC)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 9/20 1.00
CHRNA7 P36544 6/20 0.53
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PDE2A O00408 1/20 0.46

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
SCHEMBL15807032 0.88 GPR88 (0.78) GPR88CHRNA7
SCHEMBL15807036 0.87 GPR88 (0.77) GPR88CHRNA7
SCHEMBL22856675 0.83 GPR88 (0.71) GPR88CHRNA7
SCHEMBL10261086 0.83 GPR88 (0.71) GPR88CHRNA7
SCHEMBL15248899 0.83 GPR88 (0.71) GPR88CHRNA7
SCHEMBL15239361 0.83 GPR88 (0.71) GPR88CHRNA7
SCHEMBL16455119 0.83 GPR88 (0.71) GPR88CHRNA7
SCHEMBL2505801 0.83 GPR88 (0.71) GPR88CHRNA7
SCHEMBL15806712 0.82 CHRNA7 (0.70) GPR88CHRNA7
SCHEMBL15806716 0.80 GPR88 (0.66) GPR88CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8497271-B2 Modulators of G protein-coupled receptor 88 BRISTOL-MYERS SQUIBB COMPANY (US) 2013-07-30 US disclosed
US-8497271-B2 Modulators of G protein-coupled receptor 88 BRISTOL-MYERS SQUIBB COMPANY (US) 2013-07-30 US disclosed
US-20110245264-A1 Modulators of G Protein-Coupled Receptor 88 Bristol-Myers Squibb Company and Lexicon Pharmaceuticals, Inc. 2011-10-06 US disclosed
US-20110245264-A1 Modulators of G Protein-Coupled Receptor 88 Bristol-Myers Squibb Company and Lexicon Pharmaceuticals, Inc. 2011-10-06 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-20110245264-A1 Modulators of G Protein-Coupled Receptor 88 GPR88, GPR68, GRK2 GPR88 1/4885CHRNA7 180/4885MEN1 4360/4885

“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.