SCHEMBL19730393

SCHEMBL19730393

O=C(Cc1c(-c2ccc(Cl)cc2)nc2c(Cl)cc(Cl)cn12)NCCc1ccc(O)c(O)c1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TSPO P30536 2/20 0.52
▸ GMNN O75496 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ POLB P06746 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ BLM P54132 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52

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
SCHEMBL19730400 0.94 — —
SCHEMBL19730392 0.89 GABRA2 (0.53) TSPO
SCHEMBL19730395 0.83 GABRA2 (0.52) —
SCHEMBL19730396 0.83 TSPO (0.50) TSPOGMNNLMNAPOLBCYP3A4
SCHEMBL19730399 0.79 TSPO (0.53) TSPOGMNNLMNAPOLBCYP3A4
SCHEMBL19730391 0.78 — —
SCHEMBL19730390 0.74 TSPO (0.47) TSPO
SCHEMBL19730398 0.72 GABRA2 (0.49) TSPO
SCHEMBL19730397 0.69 SLC2A2 (0.55) TSPO
SCHEMBL2266963 0.69 MAPT (0.68) GMNNLMNAPOLBCYP3A4BLM

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-10202376-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-02-12 — — US disclosed
US-20170362223-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-12-21 — — US disclosed
US-20170362223-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-12-21 — — 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 (2 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-10202376-B2 Heterocyclic compound GRIN2A, GRIN1, GRIN2B TSPO 392/4885GMNN 3056/4885LMNA 3379/4885
US-20170362223-A1 HETEROCYCLIC COMPOUND GRIN2A, GRIN1, GRIN2B TSPO 392/4885GMNN 3056/4885LMNA 3379/4885

“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.

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