SCHEMBL5792740

SCHEMBL5792740

Cc1cc(N2CCCN(CCCN3CCCC3)CC2)nc(N)n1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CRHBP P24387 2/20 0.68
▸ CRHR2 Q13324 2/20 0.68
▸ SMN1; SMN2 Q16637 1/20 0.68
▸ HRH4 Q9H3N8 4/20 0.60
▸ EHMT2 Q96KQ7 1/20 0.59
▸ MAPT P10636 1/20 0.52
▸ GFER P55789 1/20 0.52
▸ HRH3 Q9Y5N1 4/20 0.48
▸ NUDT1 P36639 2/20 0.47

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
SCHEMBL5792121 0.92 CRHBP (0.61) CRHBPCRHR2SMN1; SMN2HRH4EHMT2
SCHEMBL5791838 0.88 CRHBP (0.62) CRHBPCRHR2SMN1; SMN2HRH4EHMT2
SCHEMBL5788921 0.84 CRHBP (0.96) CRHBPCRHR2SMN1; SMN2HRH4EHMT2
SCHEMBL5792077 0.84 CRHBP (0.56) CRHBPCRHR2SMN1; SMN2HRH4EHMT2
SCHEMBL5792620 0.83 CASP1 (0.61) CRHBPCRHR2SMN1; SMN2HRH4EHMT2
SCHEMBL5789915 0.83 CRHBP (0.55) CRHBPCRHR2SMN1; SMN2HRH4EHMT2
SCHEMBL24313224 0.82 CRHBP (1.00) CRHBPCRHR2SMN1; SMN2HRH4EHMT2
SCHEMBL6600071 0.82 CRHBP (1.00) CRHBPCRHR2SMN1; SMN2HRH4EHMT2
SCHEMBL5792508 0.82 CRHBP (0.60) CRHBPCRHR2SMN1; SMN2HRH4EHMT2
SCHEMBL5788914 0.81 HRH4 (0.73) CRHBPCRHR2SMN1; SMN2HRH4MAPT

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
WO-2006016014-A1 NOVEL COMPOUNDS OF A 6-METHYL-PYRIMIDINE-2,4-DIAMINE FAMILY, METHOD FOR SYNTHESISING, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF L'OREAL (FR) 2006-02-16 — — WO claimed
EP-1437348-A1 6-methyl-2,4-diamino-pyrimidine derivatives, process for preparation, compositions containing them and their uses as basic neutralising agents L'OREAL (FR) 2004-07-14 — — EP claimed
WO-2006016014-A1 NOVEL COMPOUNDS OF A 6-METHYL-PYRIMIDINE-2,4-DIAMINE FAMILY, METHOD FOR SYNTHESISING, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF L'OREAL (FR) 2006-02-16 — — WO disclosed
EP-1437348-A1 6-methyl-2,4-diamino-pyrimidine derivatives, process for preparation, compositions containing them and their uses as basic neutralising agents L'OREAL (FR) 2004-07-14 — — EP disclosed
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