SCHEMBL23460135

SCHEMBL23460135

CCCN(C(=O)O)C(=O)c1ccc(-c2csc(N(C)C)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GRM1 Q13255 7/20 0.49
▸ KMT2A Q03164 10/20 0.47
▸ RAD52 P43351 2/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ MAPT P10636 1/20 0.47
▸ MEN1 O00255 6/20 0.46
▸ POLB P06746 2/20 0.46
▸ NPC1 O15118 3/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ ALOX15 P16050 1/20 0.43

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
SCHEMBL29983701 0.85 KMT2A (0.46) GRM1KMT2ARAD52RAB9AMAPT
SCHEMBL23460215 0.82 KMT2A (0.50) GRM1KMT2ARAD52RAB9AMAPT
SCHEMBL1474111 0.79 RAB9A (0.63) GRM1KMT2ARAB9AMAPTMEN1
SCHEMBL23460116 0.76 KDM4E (0.57) GRM1KMT2ARAB9AMAPTMEN1
SCHEMBL17107193 0.74 KMT2A (0.65) GRM1KMT2ARAD52RAB9AMEN1
SCHEMBL23486294 0.73 RAB9A (0.42) GRM1KMT2ARAD52RAB9AMAPT
SCHEMBL23460138 0.71 RAB9A (0.44) GRM1KMT2ARAD52RAB9AMAPT
SCHEMBL9481963 0.70 RAB9A (0.62) GRM1KMT2ARAB9AMAPTMEN1
SCHEMBL17107155 0.69 GRM1 (0.87) GRM1KMT2ARAB9AMAPTMEN1
SCHEMBL17107109 0.69 GRM1 (0.64) GRM1KMT2ARAD52RAB9AMAPT

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-20230065034-A1 CRF RECEPTOR ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. 2023-03-02 — — US disclosed
EP-4069697-A1 CRF RECEPTOR ANTAGONISTS AND METHODS OF USE Neurocrine Biosciences, Inc. (US) 2022-10-12 — — EP disclosed
WO-2021113263-A1 CRF RECEPTOR ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. (US) 2021-06-10 — — 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-20230065034-A1 CRF RECEPTOR ANTAGONISTS AND METHODS OF USE CRHR1, CRH, CRHR2 GRM1 89/4885KMT2A 4183/4885RAD52 2502/4885

“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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