SCHEMBL27267923

SCHEMBL27267923

CCCCC1=C(C(O)c2ccccn2)NC(C=O)N1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNA5 P22460 5/20 0.35
▸ KCNJ5 P48544 1/20 0.35
▸ KCNJ3 P48549 1/20 0.35
▸ SCN5A Q14524 1/20 0.35
▸ KCND3 Q9UK17 1/20 0.35
▸ KCNH2 Q12809 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ CYP1A2 P05177 2/20 0.34
▸ MAPT P10636 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ KCNE1 P15382 1/20 0.33
▸ LMNA P02545 2/20 0.32
▸ CYP2C19 P33261 2/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ GAA P10253 1/20 0.32

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
SCHEMBL27275820 0.88 ALDH1A1 (0.36) KCNA5KCNJ5KCNJ3SCN5AKCND3
SCHEMBL27274400 0.80 CYP51A1 (0.32) ALDH1A1MAPTCYP3A4KDM4E
Pyridine SCHEMBL27267301 0.70 TDP1 (0.37) KCNH2
SCHEMBL27266927 0.67 CYP17A1 (0.33) LMNACYP3A4SMN1; SMN2
SCHEMBL10502325 0.67 POLB (0.38) KCNA5KCNJ5KCNJ3SCN5AKCND3
Pyridine SCHEMBL27266528 0.65 TDP1 (0.36) —
SCHEMBL7275282 0.64 KCNA5 (0.50) KCNA5KCNJ5KCNJ3SCN5AKCND3
SCHEMBL1526122 0.64 KCNA5 (0.50) KCNA5KCNJ5KCNJ3SCN5AKCND3
SCHEMBL8889041 0.63 MAPT (0.44) KCNA5KCNJ5KCNJ3SCN5AKCND3
SCHEMBL8986648 0.63 KCNA5 (0.49) KCNA5KCNJ5KCNJ3SCN5AKCND3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1031264-C Preparation of 1,3-dihydro-4-pyridoyl-2H-imidazol-2-ones MERRELL DOW PHARMA (US) 1996-03-13 — — CN disclosed
CN-1019197-B Preparation of 1-3-dihydro-4-pyridinoacyl-2H-imidazol-2-ones MERRELL DOW PHARMACEVTICALS IN (US) 1992-11-25 — — CN disclosed
CN-1057261-A The preparation of 1-3-dihydro-4-pyridine acyl-2H-imidazole-2-ketone compound MERRELL DOW PHARMACOUTICALS IN (US) 1991-12-25 — — CN disclosed
CN-1055737-A The preparation of 1-3-dihydro-4-pyridine acyl-2H-imidazole-2-ketone compound MERRELL DOW PHARMA (US) 1991-10-30 — — CN disclosed
CN-85106722-A Preparation of 1, 3-dihydro-4-pyridinoacyl-2H-imidazol-2-ones — 1987-03-25 — — CN disclosed
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