SCHEMBL30621963

SCHEMBL30621963

CC1(NC(=O)[C@@H]2CC2(F)F)CCN(Cc2nc(Cl)ncc2Cl)CC1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.32
▸ CNR1 P21554 1/20 0.32
▸ CNR2 P34972 1/20 0.32
▸ OGA O60502 2/20 0.32
▸ DRD2 P14416 1/20 0.32
▸ MCHR1 Q99705 1/20 0.31
▸ CCR3 P51677 1/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ JAK1 P23458 1/20 0.31
▸ TYK2 P29597 1/20 0.31
▸ NSD2 O96028 2/20 0.30
▸ HDAC3 O15379 1/20 0.30
▸ HDAC4 P56524 1/20 0.30
▸ HDAC1 Q13547 1/20 0.30
▸ HDAC7 Q8WUI4 1/20 0.30
▸ HDAC2 Q92769 1/20 0.30
▸ HDAC10 Q969S8 1/20 0.30
▸ HDAC11 Q96DB2 1/20 0.30
▸ HDAC8 Q9BY41 1/20 0.30
▸ HDAC6 Q9UBN7 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
SCHEMBL29097568 1.00 DPP4 (0.32) DPP4CNR1CNR2OGADRD2
SCHEMBL29097717 0.82 HCRTR2 (0.37) CNR1JAK2JAK1TYK2HDAC3
SCHEMBL30621978 0.82 HCRTR2 (0.37) CNR1JAK2JAK1TYK2HDAC3
SCHEMBL29097572 0.80 MAP3K7 (0.47) JAK2TYK2
SCHEMBL31318205 0.78 STK17B (0.46) DRD2MCHR1
SCHEMBL29097706 0.74 SCN9A (0.34) —
SCHEMBL30621970 0.74 SCN9A (0.34) —
SCHEMBL29097722 0.72 PTPN11 (0.39) —
SCHEMBL30621964 0.72 PTPN11 (0.39) —
SCHEMBL29097567 0.72 PDCD1 (0.33) CNR1CNR2

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
EP-4745132-A1 PYRIMIDINAMINE NUAK INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF Technoderma Medicines Inc. (CN) 2026-05-20 — — EP disclosed
WO-2025011447-A1 PYRIMIDINAMINE NUAK INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 特科罗生物科技(成都)有限公司 2025-01-16 — — WO disclosed
CN-116903592-A Pyrimidine amine NUAK inhibitor and preparation method and application thereof 特科罗生物科技(成都)有限公司 2023-10-20 — — CN disclosed
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