SCHEMBL11006867

SCHEMBL11006867

CCNc1nc(CC)c(C(=O)c2ccc(N)c([N+](=O)[O-])c2)s1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CCNA2 P20248 6/20 0.47
▸ CDK2 P24941 6/20 0.47
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ MAPT P10636 3/20 0.45
▸ LMNA P02545 1/20 0.44
▸ HCAR3 P49019 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ CDK5 Q00535 2/20 0.41
▸ CDK5R1 Q15078 2/20 0.41
▸ CRHBP P24387 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ BRCA1 P38398 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ RAB9A P51151 1/20 0.40

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
SCHEMBL11005921 0.91 MAPT (0.46) CCNA2CDK2MEN1KMT2AMAPT
SCHEMBL11008126 0.88 CCNA2 (0.48) CCNA2CDK2MEN1KMT2AMAPT
SCHEMBL11004609 0.88 VCAM1 (0.51) CCNA2CDK2MEN1KMT2AMAPT
SCHEMBL11034427 0.86 CCNA2 (0.54) CCNA2CDK2MEN1KMT2AMAPT
SCHEMBL10954333 0.79 CLK2 (0.52) CCNA2CDK2MEN1KMT2AMAPT
SCHEMBL10956535 0.78 CLK2 (0.48) CCNA2CDK2MEN1KMT2AMAPT
SCHEMBL11003299 0.78 VCAM1 (0.52) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL10956678 0.78 CCNA2 (0.44) CCNA2CDK2MEN1KMT2AMAPT
SCHEMBL10957323 0.77 CDK2 (0.63) CCNA2CDK2MEN1KMT2AMAPT
SCHEMBL10960186 0.76 ALDH1A1 (0.56) CCNA2CDK2MEN1KMT2AMAPT

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-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
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