SCHEMBL24464172

SCHEMBL24464172

Cc1cnc(-c2cc(OCC(=O)NC3CC3)ccc2F)nc1Nc1ccc(N)c(C=N)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 9/20 0.52
▸ ROCK1 Q13464 8/20 0.52
▸ LMNA P02545 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SLC2A1 P11166 1/20 0.38
▸ SLC2A3 P11169 1/20 0.38
▸ SYK P43405 3/20 0.37
▸ PLK4 O00444 1/20 0.37
▸ AURKA O14965 1/20 0.37
▸ PDPK1 O15530 1/20 0.37
▸ DAPK3 O43293 1/20 0.37
▸ JAK2 O60674 1/20 0.37
▸ MAP4K4 O95819 1/20 0.37
▸ PAK4 O96013 1/20 0.37
▸ CHEK2 O96017 1/20 0.37
▸ EGFR P00533 1/20 0.37

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
SCHEMBL24464191 0.87 ROCK2 (0.55) ROCK2ROCK1LMNAMEN1KMT2A
SCHEMBL20661283 0.86 ROCK2 (0.69) ROCK2ROCK1SLC2A1SLC2A3
SCHEMBL24464187 0.85 ROCK2 (0.49) ROCK2ROCK1LMNAHPGDHTT
SCHEMBL17038104 0.84 ROCK2 (0.70) ROCK2ROCK1SLC2A1SLC2A3
SCHEMBL24862352 0.84 ROCK2 (0.55) ROCK2ROCK1MEN1KMT2AHPGD
SCHEMBL17025851 0.82 ROCK2 (0.75) ROCK2ROCK1MEN1KMT2ASLC2A1
SCHEMBL24353608 0.82 ROCK2 (0.72) ROCK2ROCK1SLC2A1SLC2A3
SCHEMBL24464197 0.77 ROCK2 (0.68) ROCK2ROCK1HPGDHTTRAB9A
SCHEMBL24741991 0.76 TUBB4A (0.40) LMNAMEN1KMT2AHPGDHTT
SCHEMBL24862354 0.74 ROCK2 (0.69) ROCK2ROCK1SLC2A1SLC2A3CLK2

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-4116293-A2 RHO KINASE INHIBITORS Kadmon Corporation, LLC (US) 2023-01-11 — — EP disclosed
EP-2903618-B1 RHO KINASE INHIBITORS KADMON CORP LLC (US) 2022-06-01 — — EP disclosed
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