SCHEMBL24851850

SCHEMBL24851850

c1ccc(Cn2ncc3cnc(Nc4nc(N5CCCC5)cc(N5CCNCC5)n4)cc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 4/20 0.41
▸ CCND1 P24385 2/20 0.41
▸ CASP1 P29466 2/20 0.41
▸ CASP5 P51878 2/20 0.41
▸ PIM1 P11309 5/20 0.40
▸ PIM3 Q86V86 5/20 0.40
▸ PIM2 Q9P1W9 5/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ PKM P14618 1/20 0.40
▸ RECQL P46063 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CDK6 Q00534 2/20 0.39
▸ PDE4A P27815 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ PDE4C Q08493 1/20 0.38

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
SCHEMBL30162131 1.00 CDK4 (0.41) CDK4CCND1CASP1CASP5PIM1
SCHEMBL24851328 0.91 CASP1 (0.46) CDK4CASP1CASP5PIM1PIM3
SCHEMBL30161962 0.91 CASP1 (0.46) CDK4CASP1CASP5PIM1PIM3
SCHEMBL24851149 0.83 PIM1 (0.47) PIM1PIM3PIM2ALDH1A1
SCHEMBL24851285 0.83 PIM1 (0.45) CASP1CASP5PIM1PIM3PIM2
SCHEMBL30161933 0.82 CDK4 (0.45) CDK4CCND1CASP1CASP5PIM1
SCHEMBL24851155 0.82 CDK4 (0.45) CDK4CCND1CASP1CASP5PIM1
SCHEMBL30162044 0.81 CDK4 (0.49) CDK4CCND1CASP1CASP5PIM1
SCHEMBL24851179 0.81 CDK4 (0.49) CDK4CCND1CASP1CASP5PIM1
SCHEMBL24852386 0.80 CHRM2 (0.38) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023278483-A1 COMPOUNDS HAVING 1H-PYRAZOLO[4,3-C]PYRIDIN-6-AMINOS AS THERAPEUTIC AGENTS LOMOND THERAPEUTICS, INC. (US) 2023-01-05 — — WO disclosed
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