SCHEMBL30162011

SCHEMBL30162011

c1c(N2CCCC2)nc(Nc2cc3c(cn2)cnn3C2CCCC2)nc1N1CCNCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 16/20 0.44
▸ CDK6 Q00534 5/20 0.42
▸ CCND1 P24385 10/20 0.42
▸ CCND2 P30279 6/20 0.42
▸ CCND3 P30281 6/20 0.42
▸ CDK2 P24941 6/20 0.42
▸ CCNA2 P20248 5/20 0.42
▸ CCNA1 P78396 4/20 0.42
▸ FGFR1 P11362 4/20 0.42
▸ FGFR2 P21802 4/20 0.42
▸ FGFR4 P22455 4/20 0.42
▸ FGFR3 P22607 4/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ CASP4 P49662 1/20 0.42
▸ CASP5 P51878 1/20 0.42
▸ CDK1 P06493 1/20 0.41
▸ HRH4 Q9H3N8 1/20 0.41
▸ PIM1 P11309 1/20 0.41
▸ PIM3 Q86V86 1/20 0.41
▸ PIM2 Q9P1W9 1/20 0.41

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
SCHEMBL24851900 1.00 CDK4 (0.44) CDK4CDK6CCND1CCND2CCND3
SCHEMBL24851095 0.99 CDK4 (0.43) CDK4CDK6CCND1CCND2CCND3
SCHEMBL30161877 0.99 CDK4 (0.43) CDK4CDK6CCND1CCND2CCND3
SCHEMBL24851156 0.92 CDK4 (0.43) CDK4CDK6CCND1CDK2CASP1
SCHEMBL30162222 0.89 CASP1 (0.49) CDK4CDK6CCND1CCND2CCND3
SCHEMBL24851468 0.89 CASP1 (0.49) CDK4CDK6CCND1CCND2CCND3
SCHEMBL30161870 0.85 CASP1 (0.37) CDK4CDK6CCND1CCND2CCND3
SCHEMBL24851195 0.85 CASP1 (0.37) CDK4CDK6CCND1CCND2CCND3
SCHEMBL24851179 0.84 CDK4 (0.49) CDK4CDK6CCND1CCND2CCND3
SCHEMBL30162044 0.84 CDK4 (0.49) CDK4CDK6CCND1CCND2CCND3

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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