SCHEMBL30989864

SCHEMBL30989864

COc1ncc(F)cc1C(=O)N(C)Cc1cccc(F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CLK1 P49759 1/20 0.51
▸ CLK2 P49760 1/20 0.51
▸ DYRK1A Q13627 1/20 0.51
▸ CLK4 Q9HAZ1 1/20 0.51
▸ DYRK1B Q9Y463 1/20 0.51
▸ SCD5 Q86SK9 1/20 0.48
▸ RIPK1 Q13546 2/20 0.47
▸ HPGD P15428 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ KMT2A Q03164 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ POLB P06746 2/20 0.43
▸ RECQL P46063 1/20 0.43
▸ HSD17B2 P37059 2/20 0.43
▸ HSD17B1 P14061 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ THRA P10827 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ PPARG P37231 1/20 0.42
▸ EGFR P00533 1/20 0.41

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
SCHEMBL30989909 0.90 CLK1 (0.48) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL30989972 0.88 ALDH1A1 (0.49) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL30989781 0.82 RIPK1 (0.46) RIPK1HPGDALDH1A1KMT2AMEN1
SCHEMBL30989882 0.81 MEN1 (0.48) RIPK1ALDH1A1KMT2AMEN1GAA
SCHEMBL30989936 0.81 RIPK1 (0.47) RIPK1ALDH1A1KMT2AMEN1GAA
SCHEMBL30989827 0.80 PIK3C3 (0.41) RIPK1KMT2AMEN1POLBGAA
SCHEMBL30989923 0.78 ALDH1A1 (0.47) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL30989886 0.78 CLK1 (0.44) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL30989930 0.76 HSP90AA1 (0.52) DYRK1AHPGDALDH1A1KMT2AMEN1
SCHEMBL30989873 0.76 MAPK1 (0.41) KMT2AMEN1

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
EP-4612131-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2025-09-10 — — EP disclosed
WO-2024095003-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2024-05-10 — — WO disclosed
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