SCHEMBL30399474

SCHEMBL30399474

CC(=O)c1ncc(Cl)nc1Cl

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 5/20 0.35
SIRT6 Q8N6T7 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
GRM5 P41594 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
MAPK1 P28482 1/20 0.33
MAPKAPK2 P49137 2/20 0.33
PTK2 Q05397 1/20 0.32
NAPRT Q6XQN6 1/20 0.31
PTGS2 P35354 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL14775168 1.00 MEN1 (0.37) MEN1KMT2AALDH1A1SIRT6TDP1
SCHEMBL27778060 0.83 SIRT6 (0.38) MEN1KMT2AALDH1A1SIRT6TDP1
SCHEMBL31278788 0.82 SMN1; SMN2 (0.40) MEN1KMT2AALDH1A1GRM5SMN1; SMN2
SCHEMBL30937725 0.82 ALDH1A1 (0.38) MEN1KMT2AALDH1A1SIRT6TDP1
SCHEMBL21823124 0.82 SMN1; SMN2 (0.40) MEN1KMT2AALDH1A1GRM5SMN1; SMN2
SCHEMBL25396719 0.81 SIRT6 (0.41) MEN1KMT2AALDH1A1SIRT6TDP1
SCHEMBL29535934 0.81 MEN1 (0.46) MEN1KMT2AALDH1A1SIRT6TDP1
SCHEMBL1615193 0.81 MEN1 (0.46) MEN1KMT2AALDH1A1SIRT6TDP1
SCHEMBL24097752 0.80 PLAU (0.42) MEN1KMT2AALDH1A1TDP1GRM5
SCHEMBL29829126 0.79 SIRT6 (0.48) MEN1KMT2ASIRT6GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025128777-A1 INDAZOLE DERIVATIVES USEFUL AS INHIBITORS OF NOD-LIKE RECEPTOR PROTEIN 3 MERCK SHARP & DOHME LLC (US) 2025-06-19 WO disclosed
CN-109789146-B Chemokine receptor modulators and uses thereof 拉普特医疗公司 2023-04-18 CN disclosed