SCHEMBL11034427

SCHEMBL11034427

CCNc1nc(CC)c(C(=O)c2ccc(N)c(N)c2)s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNA2 P20248 9/20 0.54
▸ CDK2 P24941 9/20 0.54
▸ MAPT P10636 4/20 0.46
▸ CDK5 Q00535 3/20 0.46
▸ HTT P42858 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ CDK5R1 Q15078 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ BRCA1 P38398 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ LIMK1 P53667 2/20 0.42
▸ CLK2 P49760 1/20 0.42
▸ GSK3A P49840 1/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ CDK9 P50750 1/20 0.42
▸ DYRK1A Q13627 1/20 0.42
▸ CLK4 Q9HAZ1 1/20 0.42

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
Hydrochloric Acid SCHEMBL11008565 0.88 CCNA2 (0.48) CCNA2CDK2MAPTCDK5HTT
SCHEMBL11010419 0.86 CCNA2 (0.55) CCNA2CDK2MAPTCDK5HTT
SCHEMBL11006867 0.86 CCNA2 (0.47) CCNA2CDK2MAPTCDK5HTT
SCHEMBL11004609 0.77 VCAM1 (0.51) CCNA2CDK2MAPTHTTMEN1
SCHEMBL10957090 0.75 CLK2 (0.58) CCNA2CDK2MAPTCDK5HTT
SCHEMBL11005921 0.75 MAPT (0.46) CCNA2CDK2MAPTCDK5HTT
SCHEMBL10954897 0.74 ADORA2A (0.47) CCNA2CDK2MAPTCDK5HTT
Hydrochloric Acid SCHEMBL11496466 0.73 CCNA2 (0.54) CCNA2CDK2MAPTCDK5HTT
SCHEMBL10956552 0.73 CCNA2 (0.64) CCNA2CDK2MAPTHTTRAB9A
SCHEMBL11008126 0.73 CCNA2 (0.48) CCNA2CDK2MAPTCDK5HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0008047-B1 5(6)-(2-AMINO-5-THIAZOLOYL)BENZIMIDAZOLE-2-CARBAMIC ACID ESTERS AND THEIR SALTS, THEIR PREPARATION AND USE, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CIBA-GEIGY AG (CH) 1985-12-04 — — EP disclosed
US-4386097-A Benzimidazoles, processes for their preparation and pharmaceutical preparations containing such compounds CIBA-GEIGY CORPORATION (US) 1983-05-31 — — US disclosed
US-4297365-A Benzimidazoles and pharmaceutical preparations containing such compounds CIBA-GEIGY CORPORATION (US) 1981-10-27 — — US disclosed
EP-0008047-A1 5(6)-(2-Amino-5-thiazoloyl)benzimidazole-2-carbamic acid esters and their salts, their preparation and use, and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1980-02-20 — — EP disclosed
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