SCHEMBL4879923

SCHEMBL4879923

Cc1c(-c2ccsc2)nc2ccccc2c1C(=O)O

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 5/20 0.72
TSHR P16473 1/20 0.72
DHODH Q02127 13/20 0.68
KMT2A Q03164 1/20 0.58
LMNA P02545 1/20 0.50
TACR3 P29371 1/20 0.49

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
SCHEMBL4875991 0.87 KDM4E (0.55) PDE10ATSHRDHODHKMT2ATACR3
SCHEMBL1581468 0.84 PDE10A (1.00) PDE10ATSHRDHODHKMT2ALMNA
Hydrochloric Acid SCHEMBL27511204 0.83 PDE10A (0.97) PDE10ATSHRDHODHKMT2ALMNA
SCHEMBL5420345 0.82 LMNA (0.49) PDE10ATSHRDHODHKMT2ALMNA
SCHEMBL4874592 0.77 PDE10A (0.65) PDE10ATSHRDHODHKMT2ATACR3
SCHEMBL4875465 0.75 PDE10A (0.74) PDE10ATSHRDHODHKMT2ATACR3
SCHEMBL9788773 0.75 DHODH (0.80) PDE10ATSHRDHODHKMT2ALMNA
SCHEMBL2373562 0.75 PDE10A (0.74) PDE10ATSHRDHODHKMT2ALMNA
SCHEMBL14106730 0.75 PDE10A (0.72) PDE10ATSHRDHODHKMT2ALMNA
SCHEMBL4875432 0.74 KDM4E (0.49) PDE10ATSHRKMT2ALMNATACR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080261945-A1 Compounds Having Activity at Nk3 Receptor and Uses Thereof in Medicine SMITHKLINE BEECHAM CORPORATION (US) 2008-10-23 US disclosed
US-20080261945-A1 Compounds Having Activity at Nk3 Receptor and Uses Thereof in Medicine SMITHKLINE BEECHAM CORPORATION (US) 2008-10-23 US disclosed
US-20080261945-A1 Compounds Having Activity at Nk3 Receptor and Uses Thereof in Medicine SMITHKLINE BEECHAM CORPORATION (US) 2008-10-23 US disclosed
EP-1812398-A1 COMPOUNDS HAVING ACTIVITY AT NK3 RECEPTOR AND USES THEREOF IN MEDICINE SmithKline Beecham Corporation (US) 2007-08-01 EP disclosed
WO-2006050991-A1 COMPOUNDS HAVING ACTIVITY AT NK3 RECEPTOR AND USES THEREOF IN MEDICINE SMITHKLINE BEECHAM CORPORATION (US) 2006-05-18 WO disclosed
WO-2006050992-A1 COMPOUNDS HAVING ACTIVITY AT NK3 RECEPTOR AND USES THEREOF IN MEDICINE SMITHKLINE BEECHAM CORPORATION (US) 2006-05-18 WO 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-20080261945-A1 Compounds Having Activity at Nk3 Receptor and Uses Thereof in Medicine CNR1, ACKR3, HCAR3 PDE10A 2915/4885TSHR 94/4885DHODH 3421/4885

“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.