SCHEMBL29915428

SCHEMBL29915428

COc1ccc(Cn2nc(CO)cc2-c2cccc(Cl)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 13/20 0.48
SLC16A1 P53985 12/20 0.48
MCTS1 Q9ULC4 8/20 0.48
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
CCKAR P32238 1/20 0.44

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
SCHEMBL22613642 0.85 SLC16A3 (0.49) SLC16A3SLC16A1MCTS1TP53MAPT
SCHEMBL22613701 0.85 SLC16A3 (0.48) SLC16A3SLC16A1MCTS1MAPTCA1
SCHEMBL22613635 0.84 SLC16A3 (0.48) SLC16A3SLC16A1MCTS1CA1CA2
SCHEMBL22613652 0.81 MAPT (0.44) TP53MAPT
SCHEMBL29915480 0.80 TP53 (0.44) SLC16A3SLC16A1MCTS1TP53MAPT
SCHEMBL18301051 0.80 SLC16A3 (0.65) SLC16A3SLC16A1MCTS1TP53MAPT
SCHEMBL20600270 0.79 MAPK14 (0.47) SLC16A3SLC16A1MCTS1MAPTCA1
SCHEMBL29487686 0.78 SLC16A3 (0.69) SLC16A3SLC16A1MCTS1
SCHEMBL18300792 0.78 SLC16A3 (0.69) SLC16A3SLC16A1MCTS1
SCHEMBL22613695 0.78 SLC16A3 (0.51) SLC16A3SLC16A1MCTS1TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11440922-B2 Heterocyclylmethylidene derivatives and their use as modulators of mGluR5 receptors Recordati Industria Chimica e Farmacentica S.p.A. (IT) 2022-09-13 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-11440922-B2 Heterocyclylmethylidene derivatives and their use as modulators of mGluR5 receptors GRM5, GRIK5, GRM2 SLC16A3 1146/4885SLC16A1 778/4885MCTS1 4563/4885

“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.